SCHEMBL7433530

SCHEMBL7433530

Cc1ccc(-c2csc(C(=N)NO)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.49
MAPT P10636 10/20 0.49
NPC1 O15118 7/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
TDP1 Q9NUW8 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ALDH1A1 P00352 4/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
POLB P06746 1/20 0.48
ALOX5 P09917 1/20 0.47
AMY1A P0DUB6 1/20 0.47
GFER P55789 1/20 0.47
KDM4E B2RXH2 5/20 0.46
SREBF2 Q12772 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL7438464 0.86 MAPT (0.54) RAB9AMAPTNPC1SMN1; SMN2CYP1A2
SCHEMBL7430766 0.86 LTA4H (0.53) RAB9AMAPTNPC1SMN1; SMN2TDP1
SCHEMBL7438575 0.84 RAB9A (0.50) RAB9AMAPTNPC1SMN1; SMN2TDP1
SCHEMBL7430029 0.84 ALDH1A1 (0.52) RAB9AMAPTNPC1SMN1; SMN2TDP1
SCHEMBL7441613 0.84 MAPT (0.50) RAB9AMAPTNPC1SMN1; SMN2CYP1A2
SCHEMBL7436552 0.84 PTGS2 (0.45) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL7435763 0.84 MAPT (0.55) RAB9AMAPTNPC1SMN1; SMN2ALDH1A1
SCHEMBL7437048 0.82 ATP4A (0.51) RAB9AMAPTNPC1SMN1; SMN2TDP1
SCHEMBL7444812 0.81 HDAC1 (0.49) MAPTNPSR1ALDH1A1MEN1KMT2A
SCHEMBL7428965 0.78 RAB9A (0.55) RAB9AMAPTNPC1SMN1; SMN2CYP1A2

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
EP-0506194-B1 4-aryl-thiazole or imidazole derivatives AKZO NOBEL NV (NL) 1996-08-21 EP disclosed
US-5462959-A 4-aryl-imidazole derivatives AKZO N.V. (NL) 1995-10-31 US disclosed
US-5254575-A 4-aryl-thiazole derivatives AKZO N.V. (NL) 1993-10-19 US disclosed
EP-0506194-A1 4-aryl-thiazole or imidazole derivatives Akzo Nobel N.V. (NL) 1992-09-30 EP disclosed