SCHEMBL6971196

SCHEMBL6971196

COc1cc(N)ccc1C(=O)Nc1nc(C(=O)NCCN(C(C)C)C(C)C)cs1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.73
NPC1 O15118 5/20 0.46
RAB9A P51151 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
KDM4E B2RXH2 1/20 0.46
MITF O75030 1/20 0.46
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MME P08473 1/20 0.41
GCK P35557 3/20 0.41
TSHR P16473 2/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 2/20 0.37
POLB P06746 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.37
TP53 P04637 3/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.36

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
Hydrochloric Acid SCHEMBL6963780 0.89 ACHE (0.77) ACHENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL28440118 0.88 ACHE (0.85) ACHENPC1RAB9ASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL6976423 0.87 ACHE (0.74) ACHENPC1RAB9ASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL6962311 0.87 ACHE (0.71) ACHENPC1RAB9ASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL6973844 0.86 ACHE (0.81) ACHENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL6976759 0.86 ACHE (0.68) ACHENPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL6971272 0.86 ACHE (0.68) ACHENPC1RAB9ASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL6968413 0.85 ACHE (0.86) ACHENPC1RAB9ASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL6963251 0.85 ACHE (0.71) ACHERAB9ALMNAALDH1A1
SCHEMBL6972097 0.85 ACHE (0.86) ACHENPC1RAB9ASMN1; SMN2KDM4E

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-0870765-B1 AMINOTHIAZOLE DERIVATIVES, DRUG CONTAINING THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE COMPOUNDS ZERIA PHARM CO LTD (JP) 2003-11-19 EP disclosed
US-5981557-A HAVING IMPROVING EFFECTS ON THE DYSMOTILITY IN THE GASTROINTESTINAL TRACT ZERIA PHARMACEUTICAL CO., LTD. (JP) 1999-11-09 US disclosed
EP-0870765-A1 AMINOTHIAZOLE DERIVATIVES, DRUG CONTAINING THE SAME AND INTERMEDIATE IN THE PRODUCTION OF THE COMPOUNDS ZERIA PHARMACEUTICAL CO., LTD. (JP) 1998-10-14 EP disclosed