SCHEMBL7145072

SCHEMBL7145072

C=C(Cc1ccc(C2C3CC4CC(C3)CC2C4)c(Cl)c1)C(CN)C1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.35
CSNK2A1 P68400 2/20 0.32
EPHX2 P34913 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
SCHEMBL7136149 0.87
Hydrochloric Acid SCHEMBL7511016 0.86 CSNK2A1 (0.30) CSNK2A1
SCHEMBL7137678 0.86 SCN9A (0.36) SCN9A
SCHEMBL7139134 0.82 EPHX1 (0.31)
Hydrochloric Acid SCHEMBL7510453 0.81 KDM4E (0.31)
SCHEMBL7143023 0.79 P2RX7 (0.32) CSNK2A1
SCHEMBL7144422 0.78 SIGMAR1 (0.31) CSNK2A1
Hydrochloric Acid SCHEMBL7517090 0.77 OPRK1 (0.32) CSNK2A1
SCHEMBL7144492 0.74 MEN1 (0.39) SCN9A
SCHEMBL2639483 0.73 SCN9A (0.38) SCN9AEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1192122-B1 BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI SYNTHELABO (FR) 2003-10-22 EP claimed
US-6482986-B1 Benzene derivatives, preparation method and pharmaceutical compositions containing same SANOFI-SYNTHELABO (FR) 2002-11-19 US claimed
EP-1192122-B1 BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI SYNTHELABO (FR) 2003-10-22 EP disclosed
US-6482986-B1 Benzene derivatives, preparation method and pharmaceutical compositions containing same SANOFI-SYNTHELABO (FR) 2002-11-19 US disclosed