SCHEMBL4787348

SCHEMBL4787348

CCCCCNC(=O)Nc1ccc(Oc2ccc(N)cc2)c(C)c1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.55
EPHX1 P07099 10/20 0.53
ALDH1A1 P00352 2/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.47
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
KDR P35968 2/20 0.46
TBXA2R P21731 2/20 0.45

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
SCHEMBL4786969 0.93 EPHX2 (0.52) EPHX2EPHX1ALDH1A1MAPTHTT
SCHEMBL4785993 0.89 EPHX1 (0.53) EPHX2EPHX1ALDH1A1MAPTHTT
SCHEMBL4786099 0.88 EPHX1 (0.52) EPHX2EPHX1ALDH1A1MAPTHTT
SCHEMBL4787476 0.88 EPHX1 (0.52) EPHX2EPHX1ALDH1A1MAPTHTT
SCHEMBL4786912 0.88 KDR (0.54) EPHX2EPHX1ALDH1A1MAPTHTT
SCHEMBL5149417 0.88 EPHX1 (0.52) EPHX2EPHX1ALDH1A1HTTHDAC1
SCHEMBL4787105 0.88 EPHX1 (0.52) EPHX2EPHX1ALDH1A1HTTHDAC1
SCHEMBL4783970 0.88 EPHX2 (0.60) EPHX2EPHX1ALDH1A1HTT
SCHEMBL4685589 0.86 EPHX1 (0.50) EPHX2EPHX1ALDH1A1HTTHDAC1
SCHEMBL4787668 0.86 MAPT (0.51) EPHX2EPHX1ALDH1A1MAPTHTT

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-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO disclosed