SCHEMBL7894249

SCHEMBL7894249

COc1ccccc1-c1csc(NC(=O)c2cc3ccccc3[nH]2)n1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
KDM4E B2RXH2 2/20 0.57
MAPK1 P28482 1/20 0.57
KMT2A Q03164 6/20 0.54
MEN1 O00255 5/20 0.54
RECQL P46063 1/20 0.54
NPC1 O15118 3/20 0.53
PHGDH O43175 1/20 0.53
RAB9A P51151 2/20 0.52
HPGDS O60760 1/20 0.52
VCP P55072 1/20 0.50
IMPDH2 P12268 1/20 0.49
PLCG2 P16885 1/20 0.48
ATP4A P20648 1/20 0.48
ATP4B P51164 1/20 0.48
FLT3 P36888 1/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ADORA3 P0DMS8 1/20 0.47

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
SCHEMBL7894112 0.90 NPC1 (0.52) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL8893759 0.87 KMT2A (0.49) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL27535560 0.86 NPC1 (0.47) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL7901474 0.86 NPC1 (0.50) MAPTKDM4EMAPK1NPC1RAB9A
SCHEMBL27426133 0.86 NPC1 (0.50) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL8894553 0.86 NPC1 (0.50) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL7901407 0.86 NPC1 (0.55) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL8895004 0.86 KMT2A (0.48) MAPTKDM4EMAPK1KMT2AMEN1
Water SCHEMBL9411708 0.85 NPC1 (0.49) MAPTKDM4EMAPK1KMT2AMEN1
Hydrochloric Acid SCHEMBL27426131 0.84 ADORA3 (0.48) MAPTKDM4EMAPK1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE37094-E1 Heterocyclic substituted acylaminothiazoles, their preparation and pharmaceutical compositions containing them SANOFI (FR) 2001-03-13 US claimed
EP-0432040-B2 Heterocyclic derivatives of acylaminothiazole, their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1997-12-17 EP claimed
US-5189049-A Cholecystokinin and gastrin inhibitors SANOFI (FR) 1993-02-23 US claimed
US-RE37094-E1 Heterocyclic substituted acylaminothiazoles, their preparation and pharmaceutical compositions containing them SANOFI (FR) 2001-03-13 US disclosed
US-5189049-A Cholecystokinin and gastrin inhibitors SANOFI (FR) 1993-02-23 US disclosed