SCHEMBL8896650

SCHEMBL8896650

COc1cc(Cl)cc(OC)c1-c1csc(N)n1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.63
KDM4E B2RXH2 2/20 0.63
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
HSD17B10 Q99714 2/20 0.53
NPC1 O15118 3/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 3/20 0.47
POLB P06746 1/20 0.47
LTA4H P09960 4/20 0.45
GFER P55789 2/20 0.45
GAA P10253 1/20 0.44
HSP90AA1 P07900 2/20 0.43
HSP90AB1 P08238 2/20 0.43
ALOX5 P09917 1/20 0.39
THRB P10828 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
SCHEMBL8894861 0.86 MEN1 (0.54) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL2379547 0.86 ALDH1A1 (0.56) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL14993071 0.82 HSD17B10 (0.52) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL8896465 0.81 HSD17B10 (0.51) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL16644714 0.79 MEN1 (0.50) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL14992602 0.78 ALDH1A1 (0.54) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL8897844 0.78 MEN1 (0.49) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL8895221 0.78 HSD17B10 (0.55) ALDH1A1KDM4EMEN1KMT2AHSD17B10
SCHEMBL1915457 0.78 ALDH1A1 (1.00) ALDH1A1KDM4EMEN1KMT2ANPC1
SCHEMBL2382422 0.77 ALDH1A1 (0.47) ALDH1A1KDM4EMEN1KMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0611766-A1 Polysubstituted 2-amido thiazoles derivatives, process for their preparation, pharmaceutical compositions and utilization for the preparation of a medicament SANOFI (FR) 1994-08-24 EP claimed
US-5656648-A TREATMENT OF PATHOLOGIES NECESSITATING STIMULATION OF CHOLECYSTOKININ-A RECEPTORS BY TOTAL OR PARTIAL AGONIST EFFECT SANOFI (FR) 1997-08-12 US disclosed
EP-0611766-A1 Polysubstituted 2-amido thiazoles derivatives, process for their preparation, pharmaceutical compositions and utilization for the preparation of a medicament SANOFI (FR) 1994-08-24 EP disclosed