SCHEMBL10692379

SCHEMBL10692379

O=C(O)CNC(=O)C(CC(=O)NOCc1ccccc1)Cc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.70
ALDH1A1 P00352 2/20 0.59
ACE P12821 2/20 0.59
ECE1 P42892 2/20 0.59
HPGD P15428 1/20 0.59
MAPK1 P28482 1/20 0.59
HSD17B10 Q99714 1/20 0.59
MEN1 O00255 1/20 0.59
MAPT P10636 1/20 0.59
BLM P54132 1/20 0.59
NPEPPS P55786 1/20 0.59
KMT2A Q03164 1/20 0.59
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL10692623 0.89 MME (0.55) MMEALDH1A1ACEECE1HPGD
SCHEMBL7325845 0.82 MME (1.00) MMEALDH1A1ACEECE1HPGD
SCHEMBL7325851 0.82 MME (1.00) MMEALDH1A1ACEECE1HPGD
SCHEMBL7325857 0.82 MME (1.00) MMEALDH1A1ACEECE1HPGD
SCHEMBL10692309 0.81 MME (0.69) MMEALDH1A1ACEECE1HPGD
SCHEMBL10447979 0.80 MME (0.81) MMEALDH1A1ACEECE1HPGD
SCHEMBL11911567 0.76 NPC1 (0.53) NPC1RAB9A
SCHEMBL2127131 0.76 MMP2 (0.54) NPC1RAB9A
SCHEMBL859814 0.76 MMP2 (0.54) NPC1RAB9A
SCHEMBL7103054 0.76 MME (0.74) MMEALDH1A1ACEECE1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4738803-A ENZYME INHIBITORS ROQUES BERNARD (FR) 1988-04-19 US disclosed
US-4618708-A ENKEPHALINASE INHIBITOR, ANALGESICS, ANTIDEPRESSANT, ANTIDIARRHEA, OR HYPOTENSIVE AGENT ROQUES BERNARD (FR) 1986-10-21 US disclosed