SCHEMBL3063330

SCHEMBL3063330

Cc1ccc(Oc2ccc(Cc3nsc(N4CCN(S(=O)(=O)c5ccc(C#N)cc5)CC4)n3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 2/20 0.43
CFTR P13569 1/20 0.43
GPR6 P46095 1/20 0.42
KMT2A Q03164 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HSD11B1 P28845 1/20 0.42
SCN9A Q15858 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
MAPK1 P28482 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL3062212 0.90 PKM (0.44) KMT2ATSHRALDH1A1SMN1; SMN2MEN1
SCHEMBL3060852 0.90 SCN9A (0.45) L3MBTL1GAAMAPTCFTRGPR6
SCHEMBL3058037 0.89 MAPT (0.46) GAAMAPTKMT2AHSD11B1TSHR
SCHEMBL3054823 0.89 KMT2A (0.43) KMT2AHSD11B1TSHRALDH1A1SMN1; SMN2
SCHEMBL3055780 0.88 TRPV4 (0.41) MAPTGPR6KMT2ANPSR1CNR1
SCHEMBL2012893 0.86 KMT2A (0.53) L3MBTL1MAPTCFTRKMT2AHSD11B1
SCHEMBL3059277 0.84 CFTR (0.42) L3MBTL1GAAMAPTCFTRKMT2A
SCHEMBL3053842 0.83 THRB (0.43) KMT2AHSD11B1ALDH1A1MEN1LMNA
SCHEMBL3065977 0.83 KMT2A (0.53) GAAMAPTKMT2ATSHRALDH1A1
SCHEMBL3059947 0.83 ALDH1A1 (0.52) L3MBTL1GAAMAPTKMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2010-10-14 US disclosed
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-09-17 US disclosed
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-26 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-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 L3MBTL1 791/4885GAA 203/4885MAPT 9/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 L3MBTL1 791/4885GAA 203/4885MAPT 9/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 L3MBTL1 791/4885GAA 203/4885MAPT 9/4885

“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.