SCHEMBL2248337

SCHEMBL2248337

COc1c(F)c(F)c2nc(N)sc2c1F

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.46
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 1/20 0.33
ADORA1 P30542 1/20 0.33
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
ILK Q13418 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6514749 0.79 ALDH1A1 (0.47) HSD17B10ALDH1A1
SCHEMBL25344422 0.78 HSD17B10 (0.36) HSD17B10ALDH1A1LMNACYP3A4TDP1
SCHEMBL29514029 0.78 HSD17B10 (0.36) HSD17B10ALDH1A1LMNACYP3A4TDP1
SCHEMBL10874347 0.76 HTT (0.43) HSD17B10ALDH1A1LMNATDP1SMN1; SMN2
SCHEMBL19783248 0.74 ALDH1A1 (0.42) HSD17B10ALDH1A1LMNACYP3A4TDP1
SCHEMBL21901453 0.74 ALDH1A1 (0.42) HSD17B10ALDH1A1LMNACYP3A4TDP1
SCHEMBL30189744 0.74 ALDH1A1 (0.42) HSD17B10ALDH1A1LMNACYP3A4TDP1
Bromide SCHEMBL29611798 0.72 ALDH1A1 (0.41) HSD17B10ALDH1A1LMNACYP3A4TDP1
Bromide SCHEMBL21839505 0.72 ALDH1A1 (0.41) HSD17B10ALDH1A1LMNACYP3A4TDP1
SCHEMBL25346522 0.72 CYP3A4 (0.45) HSD17B10ALDH1A1LMNACYP3A4TDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312548-A1 SUBSTITUTE FUSED IMIDAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF VTV THERAPEUTICS LLC 2023-10-05 US disclosed
US-11649230-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof VTV THERAPEUTICS LLC (US) 2023-05-16 US disclosed
US-20220169641-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof VTVX HOLDINGS II LLC 2022-06-02 US disclosed
US-11130753-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof VTV THERAPEUTICS LLC (US) 2021-09-28 US disclosed
US-10889580-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof VTV THERAPEUTICS LLC (US) 2021-01-12 US disclosed
US-20210002268-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof TRANSTECH PHARMA, INC. 2021-01-07 US disclosed
US-20200148673-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof VTVX HOLDINGS II LLC 2020-05-14 US disclosed
US-10570126-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof VTV THERAPEUTICS LLC (US) 2020-02-25 US disclosed
US-20190194181-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof TRANSTECH PHARMA, INC. 2019-06-27 US disclosed
US-10287284-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof VTV THERAPEUTICS LLC (US) 2019-05-14 US disclosed
EP-2536285-A1 SUBSTITUTED FUSED IMIDAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF High Point Pharmaceuticals, LLC (US) 2012-12-26 EP disclosed
WO-2011107710-A1 USE OF RILUZOLE TO TREAT OR PREVENT THE ADVERSE EFFECTS OF ANTINEOPLASTIC AGENTS UNIVERSITE D'AUVERGNE CLERMONT I (FR) 2011-09-09 WO disclosed
WO-2011103018-A1 SUBSTITUTED FUSED IMIDAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF HIGH POINT PHARMACEUTICALS, LLC (US) 2011-08-25 WO disclosed
US-20110201604-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof HIGH POINT PHARMACEUTICALS, LLC (US) 2011-08-18 US disclosed
US-6713493-B2 Use of nicergoline in the treatment of spasticity AVENTIS PHARMA S.A. (FR) 2004-03-30 US disclosed
US-20020086875-A1 Of neurological diseases involving attack of the pyramidal pathway such as: amyotrophic lateral sclerosis, progressive spinal muscular atrophy, infantile muscular atrophy, primary lateral sclerosis and cerebrovascular accident DIB MICHEL (FR) 2002-07-04 US disclosed
US-6380208-B2 Use of nicergoline for treating spasticity AVENTIS PHARMA S.A. (FR) 2002-04-30 US disclosed
US-5656647-A ADMINISTERING; USEFUL IN X-RAY THERAPY, EXPOSURE TO NUCLEAR RADITION AND ANTICARCINOGENIC AGENTS RHONE-POULENC RORER S.A. (FR) 1997-08-12 US disclosed
US-5236940-A Administering for treatment of medical conditions associated with the effects of glutamate; glutamate-induced convulsions; schizophrenia; sleep disorders RHONE-POULENC SANTE (FR) 1993-08-17 US disclosed
US-4370338-A ANTICONVULSANT, ANXIOLYTIC, AND HYPNOTIC; RILUZOLE PHARMINDUSTRIE (FR) 1983-01-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220169641-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof GLS, HMOX2, REN HSD17B10 1206/4885ALDH1A1 1872/4885LMNA 2765/4885
US-11130753-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof GLS, HMOX2, REN HSD17B10 1206/4885ALDH1A1 1872/4885LMNA 2765/4885
US-20110201604-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof HMOX2, HMOX1, PTGS2 HSD17B10 1101/4885ALDH1A1 1757/4885LMNA 3326/4885
US-10287284-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof HMOX2, HMOX1, PTGS2 HSD17B10 1101/4885ALDH1A1 1757/4885LMNA 3326/4885
US-20230312548-A1 SUBSTITUTE FUSED IMIDAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF GLS, HMOX2, REN HSD17B10 1117/4885ALDH1A1 1697/4885LMNA 3422/4885
US-11649230-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof GLS, HMOX2, REN HSD17B10 1206/4885ALDH1A1 1872/4885LMNA 2765/4885
US-20200148673-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof GOT2, GLS2, PYGL HSD17B10 159/4885ALDH1A1 491/4885LMNA 2621/4885
US-20190194181-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof HMOX2, HMOX1, UACA HSD17B10 802/4885ALDH1A1 1046/4885LMNA 2940/4885
US-10889580-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof GOT2, GLS2, PYGL HSD17B10 159/4885ALDH1A1 491/4885LMNA 2621/4885
US-10570126-B2 Substituted fused imidazole derivatives, pharmaceutical compositions, and methods of use thereof HMOX2, HMOX1, UACA HSD17B10 802/4885ALDH1A1 1046/4885LMNA 2940/4885
US-20210002268-A1 Substituted Fused Imidazole Derivatives, Pharmaceutical Compositions, and Methods of Use Thereof GLS, HMOX2, REN HSD17B10 1206/4885ALDH1A1 1872/4885LMNA 2765/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.