SCHEMBL14934389

SCHEMBL14934389

O=C(Nc1ccc(Cl)cc1)N1CCC2(CC1)CCN(C(=O)c1c(F)cccc1F)CC2

nearest known ligand 0.87

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 17/20 0.87
▸ USP2 O75604 3/20 0.58
▸ CYP3A4 P08684 3/20 0.58
▸ CYP1A2 P05177 1/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL14934542 0.93 EPHX2 (1.00) EPHX2CYP3A4CYP1A2
SCHEMBL14934386 0.86 EPHX2 (0.88) EPHX2USP2CYP3A4CYP1A2
SCHEMBL14934503 0.81 EPHX2 (1.00) EPHX2USP2CYP3A4CYP1A2SMN1; SMN2
SCHEMBL14934390 0.80 EPHX2 (1.00) EPHX2USP2CYP3A4CYP1A2
SCHEMBL14934551 0.80 EPHX2 (0.77) EPHX2USP2CYP3A4CYP1A2
SCHEMBL14934543 0.79 EPHX2 (0.75) EPHX2USP2CYP3A4CYP1A2
SCHEMBL14934538 0.79 EPHX2 (1.00) EPHX2USP2CYP3A4CYP1A2
SCHEMBL14934387 0.79 EPHX2 (1.00) EPHX2USP2CYP3A4CYP1A2SMN1; SMN2
SCHEMBL14934547 0.79 EPHX2 (0.82) EPHX2USP2CYP3A4CYP1A2
SCHEMBL14934501 0.79 EPHX2 (1.00) EPHX2USP2CYP3A4CYP1A2

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-2013065712-A1 DIAZASPIROUREA DERIVATIVE AND PHARMACEUTICAL USE THEREOF 東レ株式会社 (JP) 2013-05-10 — — WO disclosed
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