SCHEMBL6967117

SCHEMBL6967117

COc1cc(OC)c(C(=O)Nc2nc(C(=O)Nc3ccc(N(C)C)cc3)cs2)cc1OC

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.71
ALDH1A1 P00352 5/20 0.71
MAPK1 P28482 5/20 0.71
HSD17B10 Q99714 2/20 0.71
LMNA P02545 4/20 0.53
ACHE P22303 2/20 0.49
NPC1 O15118 8/20 0.49
RAB9A P51151 6/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
TP53 P04637 1/20 0.49
KMT2A Q03164 7/20 0.48
MEN1 O00255 6/20 0.48
MCL1 Q07820 2/20 0.48
GFER P55789 1/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 2/20 0.47
RECQL P46063 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
POLB P06746 5/20 0.46
AHR P35869 2/20 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
SCHEMBL7055631 0.80 HSD17B10 (0.57) MAPTALDH1A1MAPK1HSD17B10LMNA
SCHEMBL6970367 0.80 L3MBTL1 (0.55) MAPTALDH1A1MAPK1HSD17B10LMNA
SCHEMBL6975573 0.77 ACHE (0.67) MAPTALDH1A1MAPK1HSD17B10LMNA
SCHEMBL6976204 0.76 ACHE (0.65) MAPTALDH1A1MAPK1HSD17B10LMNA
SCHEMBL6976220 0.75 LMNA (0.55) MAPTALDH1A1MAPK1HSD17B10LMNA
SCHEMBL6313414 0.75 LMNA (0.72) MAPTALDH1A1MAPK1HSD17B10LMNA
SCHEMBL6970981 0.75 ACHE (0.75) MAPTALDH1A1MAPK1HSD17B10LMNA
SCHEMBL6958811 0.75 ACHE (0.64) MAPTALDH1A1MAPK1HSD17B10LMNA
SCHEMBL28440118 0.73 ACHE (0.85) MAPTALDH1A1MAPK1HSD17B10LMNA
Maleic Acid SCHEMBL6974397 0.73 ACHE (0.61) MAPTALDH1A1MAPK1HSD17B10LMNA

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