SCHEMBL7436552

SCHEMBL7436552

Cc1ccc(-c2csc(C(=N)NO)n2)cc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.45
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 3/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 4/20 0.41
GAA P10253 3/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 4/20 0.41
ABL1 P00519 1/20 0.40
RECQL P46063 2/20 0.40
HPGD P15428 2/20 0.40
ESR2 Q92731 1/20 0.40
MPL P40238 1/20 0.38
XIAP P98170 1/20 0.37
PLAU P00749 1/20 0.37

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
SCHEMBL7433530 0.84 RAB9A (0.49) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7437048 0.82 ATP4A (0.51) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7434491 0.80 ABL1 (0.51) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL7428965 0.80 RAB9A (0.55) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL434333 0.80 MEN1 (0.55) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7438464 0.79 MAPT (0.54) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7430766 0.79 LTA4H (0.53) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7430029 0.78 ALDH1A1 (0.52) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7438575 0.78 RAB9A (0.50) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL7434680 0.78 GAA (0.62) MEN1KMT2ANPC1RAB9AALDH1A1

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