SCHEMBL2043743

SCHEMBL2043743

[CH2]CP(=O)(O)CC(Cc1ccc(-c2ccccc2)cc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 3/20 0.50
ERAP2 Q6P179 3/20 0.50
MME P08473 1/20 0.49
ACP3 P15309 1/20 0.49
CYP1A2 P05177 1/20 0.49
LAP3 P28838 3/20 0.48
ERAP1 Q9NZ08 2/20 0.48
MMEL1 Q495T6 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
SCHEMBL15766469 0.86 ANPEP (0.52) ANPEPERAP2MMEACP3CYP1A2
SCHEMBL7613048 0.80 HSD17B10 (0.58) MME
SCHEMBL7617533 0.79 CTSS (0.53) ANPEPMME
SCHEMBL15766466 0.79 MME (0.51) ANPEPERAP2MMEACP3CYP1A2
SCHEMBL24991322 0.78 ANPEP (0.76) ANPEPERAP2MMELAP3ERAP1
SCHEMBL5058107 0.77 CYP1A2 (0.61) ANPEPERAP2CYP1A2LAP3ERAP1
Bromide SCHEMBL1764739 0.77 ANPEP (0.74) ANPEPERAP2MMELAP3ERAP1
SCHEMBL10793791 0.75 MME (0.47) ANPEPMMECYP1A2
SCHEMBL7362616 0.75 MME (0.47) ANPEPMMECYP1A2
SCHEMBL7362615 0.75 MME (0.47) ANPEPMMECYP1A2

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
EP-2326655-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN Pharmaleads (FR) 2011-06-01 EP disclosed
WO-2010010106-A1 AMINOPHOSPHINIC DERIVATIVES THAT CAN BE USED IN THE TREATMENT OF PAIN PHARMALEADS (FR) 2010-01-28 WO disclosed