SCHEMBL9652192

SCHEMBL9652192

CC1SC(c2cccnc2)N(CCO)C1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
NPSR1 Q6W5P4 2/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 2/20 0.42
CYP3A4 P08684 1/20 0.42
THRB P10828 1/20 0.42
TSHR P16473 1/20 0.42
THPO P40225 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL9653901 0.87 TDP1 (0.46) MAPTNPSR1POLBMEN1KMT2A
SCHEMBL9655484 0.85 MAPT (0.44) MAPTNPSR1POLBMEN1KMT2A
SCHEMBL11120126 0.85 NPSR1 (0.43) MAPTNPSR1POLBMEN1KMT2A
SCHEMBL11057875 0.84 MAPT (0.65) MAPTNPSR1POLBMEN1KMT2A
SCHEMBL9654597 0.83 NPSR1 (0.40) MAPTNPSR1POLBMEN1KMT2A
SCHEMBL9654532 0.83 NPSR1 (0.41) MAPTNPSR1POLBMEN1KMT2A
SCHEMBL9652240 0.81 KDM4E (0.51) MAPTNPSR1POLBMEN1KMT2A
SCHEMBL3250768 0.81 KDM4E (0.51) MAPTNPSR1POLBMEN1KMT2A
SCHEMBL3250771 0.81 KDM4E (0.51) MAPTNPSR1POLBMEN1KMT2A
SCHEMBL9652237 0.81 KDM4E (0.51) MAPTNPSR1POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5106860-A Treating inflammation, circulatory disease, gastrointestinal ulceration, allergies SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-04-21 US disclosed
US-5021435-A Administering to a patient suffering from an ulcer caused by stress or gastric acid SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-06-04 US disclosed
US-4992455-A Cardiovascular disorders SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-02-12 US disclosed
EP-0325496-A1 2-Pyridyl thiazolidin-4-one derivatives as anti-ulcer agents SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1989-07-26 EP disclosed
EP-0292305-A1 Novel thiazolidin-4-one derivatives and acid addition salts thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1988-11-23 EP disclosed