SCHEMBL7962818

SCHEMBL7962818

CON(C)C(=O)C1CC1c1c[nH]c(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
MCL1 Q07820 3/20 0.38
BCL2 P10415 1/20 0.34
APP P05067 1/20 0.34
TRPM5 Q9NZQ8 2/20 0.31
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
GPR88 Q9GZN0 1/20 0.30

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
SCHEMBL7974207 0.82 RXRA (0.41) EPHX2
SCHEMBL18065068 0.74 TRPM8 (0.36)
SCHEMBL6136581 0.73
SCHEMBL7796073 0.72 SIRT2 (0.39) EPHX2MCL1BCL2APP
SCHEMBL17146213 0.71 MCL1 (0.55) EPHX2MCL1BCL2APPTRPM5
SCHEMBL15208924 0.71 MCL1 (0.55) EPHX2MCL1BCL2APPTRPM5
SCHEMBL13929891 0.71 MCL1 (0.55) EPHX2MCL1BCL2APPTRPM5
SCHEMBL17590033 0.71 MCL1 (0.55) EPHX2MCL1BCL2APPTRPM5
SCHEMBL7974225 0.71 APP (0.36) EPHX2APP
SCHEMBL20640587 0.71 GPR88 (0.47) GPR88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001081317-A1 CHIRAL IMIDAZOYL INTERMEDIATES FOR THE SYNTHESIS OF 2-(4-IMIDAZOYL)-CYCLOPROPYL DERIVATIVES GLIATECH, INC. (US) 2001-11-01 WO disclosed