SCHEMBL7901474

SCHEMBL7901474

Cc1ccccc1-c1csc(NC(=O)c2cc3ccccc3[nH]2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
LMNA P02545 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
SIRT5 Q9NXA8 1/20 0.48
TYR P14679 1/20 0.47
EGFR P00533 3/20 0.47
PIK3CA P42336 3/20 0.47
HSPA5 P11021 1/20 0.47
HSPA8 P11142 1/20 0.47
HSPA9 P38646 1/20 0.47
HSPA2 P54652 1/20 0.47
IDO1 P14902 1/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
ATP4A P20648 1/20 0.46
ATP4B P51164 1/20 0.46
MAPT P10636 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
SCHEMBL7894149 0.89 LMNA (0.50) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL7818402 0.87 LMNA (0.57) NPC1RAB9ALMNASMN1; SMN2TYR
SCHEMBL7894249 0.86 MAPT (0.57) NPC1RAB9ALMNASMN1; SMN2KDM4E
SCHEMBL7901626 0.86 LMNA (0.58) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL7899704 0.86 LMNA (0.58) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL7894167 0.84 LMNA (0.58) NPC1RAB9ALMNASMN1; SMN2KDM4E
SCHEMBL8895004 0.82 KMT2A (0.48) NPC1RAB9ALMNASMN1; SMN2KDM4E
SCHEMBL8894553 0.82 NPC1 (0.50) NPC1RAB9ALMNASMN1; SMN2EGFR
Water SCHEMBL9411708 0.81 NPC1 (0.49) NPC1RAB9ALMNASMN1; SMN2EGFR
SCHEMBL8896967 0.81 NPC1 (0.47) NPC1RAB9ALMNASMN1; SMN2EGFR

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