SCHEMBL8895004

SCHEMBL8895004

COc1cc(C)c(Cl)cc1-c1csc(NC(=O)c2cc3ccccc3[nH]2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.48
MEN1 O00255 6/20 0.48
NPC1 O15118 2/20 0.48
IMPDH2 P12268 1/20 0.47
RAB9A P51151 1/20 0.46
LMNA P02545 8/20 0.46
MAPT P10636 8/20 0.46
KDM4E B2RXH2 7/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
HTT P42858 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
MAPK1 P28482 2/20 0.45
POLB P06746 2/20 0.45
TP53 P04637 2/20 0.45
THRB P10828 2/20 0.44
HPGD P15428 4/20 0.44
RECQL P46063 1/20 0.44
ALDH1A1 P00352 5/20 0.44
ADORA3 P0DMS8 1/20 0.44
PLCG2 P16885 1/20 0.44

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
SCHEMBL8893759 0.93 KMT2A (0.49) KMT2AMEN1NPC1IMPDH2RAB9A
SCHEMBL7894249 0.86 MAPT (0.57) KMT2AMEN1NPC1IMPDH2RAB9A
SCHEMBL27535560 0.83 NPC1 (0.47) KMT2AMEN1NPC1IMPDH2RAB9A
SCHEMBL8896967 0.83 NPC1 (0.47) KMT2AMEN1NPC1IMPDH2RAB9A
SCHEMBL7901474 0.82 NPC1 (0.50) NPC1RAB9ALMNAMAPTKDM4E
SCHEMBL7818402 0.82 LMNA (0.57) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL27426133 0.82 NPC1 (0.50) KMT2AMEN1NPC1IMPDH2RAB9A
SCHEMBL8894553 0.82 NPC1 (0.50) KMT2AMEN1NPC1IMPDH2RAB9A
SCHEMBL7894112 0.82 NPC1 (0.52) KMT2AMEN1NPC1IMPDH2RAB9A
Water SCHEMBL9411708 0.81 NPC1 (0.49) KMT2AMEN1NPC1IMPDH2RAB9A

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