SCHEMBL13071968

SCHEMBL13071968

COCn1c(Br)nc(Br)c1Br

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL27077549 0.79 ALDH1A1 (0.47) HSD17B10LMNAALDH1A1RXFP1KDM4E
SCHEMBL5672991 0.78 LMNA (0.32) HSD17B10LMNAMAPTTSHR
SCHEMBL9771946 0.75 MAPT (0.39) HSD17B10LMNAMAPTALDH1A1KDM4E
SCHEMBL3402580 0.75 ADORA2A (0.40) HSD17B10KDM4E
SCHEMBL5180079 0.74 MAPT (0.36) MAPTALDH1A1RXFP1
SCHEMBL27077556 0.74 ALDH1A1 (0.40) ALDH1A1RXFP1KDM4E
SCHEMBL15007536 0.71 SMN1; SMN2 (0.51) HSD17B10MAPTTSHRALDH1A1KDM4E
SCHEMBL10341293 0.71 ALDH1A1 (0.32) HSD17B10LMNAMAPTTSHRALDH1A1
SCHEMBL18802975 0.69 PIM1 (0.39) HSD17B10TSHRALDH1A1KDM4E
SCHEMBL15007607 0.64 CSNK2A2 (0.39) HSD17B10LMNAALDH1A1KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3157904-B1 ANTI-INFECTIVE COMPOUNDS PASTEUR INSTITUT KOREA (KR) 2020-11-18 EP disclosed
US-20180044316-A1 POTENTIATORS OF BETA-LACTAM ANTIBIOTICS UNIVERSITY OF NOTRE DAME DU LAC (US) 2018-02-15 US disclosed
US-20170121349-A1 Anti-Infective Compounds INSTITUT PASTEUR KOREA (KR) 2017-05-04 US disclosed
WO-2015193506-A1 ANTI-INFECTIVE COMPOUNDS INSTITUT PASTEUR KOREA (KR) 2015-12-23 WO disclosed
US-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues LIGAND PHARMACEUTICALS, INC. (US) 2010-11-25 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 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 (3 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-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues HRH3, HRH4, HRH2 HSD17B10 3129/4885LMNA 4548/4885MAPT 342/4885
US-20180044316-A1 POTENTIATORS OF BETA-LACTAM ANTIBIOTICS CREB1, PPP6R1, PPP1R10 HSD17B10 3489/4885LMNA 2931/4885MAPT 4421/4885
US-20170121349-A1 Anti-Infective Compounds FNTB, LSS, PGLS HSD17B10 1899/4885LMNA 3151/4885MAPT 2813/4885

“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.