SCHEMBL10673115

SCHEMBL10673115

O=C1CSC(c2ccccc2C(=O)O)N1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.60
L3MBTL1 Q9Y468 3/20 0.56
GAA P10253 2/20 0.45
CYP2C9 P11712 1/20 0.41
ALDH1A1 P00352 5/20 0.39
ALOX15 P16050 1/20 0.39
KDM4E B2RXH2 3/20 0.39
NAPRT Q6XQN6 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
HMGB1 P09429 1/20 0.39
HPGD P15428 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
GFER P55789 1/20 0.38
LMNA P02545 1/20 0.36

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
SCHEMBL6827823 0.76 SMN1; SMN2 (1.00) SMN1; SMN2L3MBTL1GAACYP2C9ALDH1A1
SCHEMBL5450446 0.74 SMN1; SMN2 (0.59) SMN1; SMN2L3MBTL1GAACYP2C9ALDH1A1
SCHEMBL11024958 0.73 CYP2C9 (0.41) SMN1; SMN2L3MBTL1GAACYP2C9ALDH1A1
SCHEMBL31095880 0.69 ALDH1A1 (0.48) SMN1; SMN2L3MBTL1CYP2C9ALDH1A1ALOX15
SCHEMBL16796853 0.69 L3MBTL1 (0.68) SMN1; SMN2L3MBTL1GAACYP2C9ALDH1A1
SCHEMBL16797013 0.69 L3MBTL1 (0.68) SMN1; SMN2L3MBTL1GAACYP2C9ALDH1A1
SCHEMBL10457353 0.66 ALDH1A1 (0.54) SMN1; SMN2L3MBTL1CYP2C9ALDH1A1ALOX15
SCHEMBL4109572 0.66 ALDH1A1 (0.54) SMN1; SMN2L3MBTL1CYP2C9ALDH1A1ALOX15
SCHEMBL30175300 0.66 ALDH1A1 (0.54) SMN1; SMN2L3MBTL1CYP2C9ALDH1A1ALOX15
SCHEMBL10651485 0.66 ALDH1A1 (0.48) SMN1; SMN2L3MBTL1CYP2C9ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4722932-A ANTI-PEPTIC ULCER AGENTS KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-02-02 US disclosed
US-4540702-A 2-Substituted-4-thiazolidones KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-09-10 US disclosed