SCHEMBL15340286

SCHEMBL15340286

CCCCCC1CCC(c2ccc(C3CCC(c4ccc(OCC)cc4)CO3)c(F)c2C)CC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.32
RAB9A P51151 1/20 0.32
CYP2C9 P11712 1/20 0.31
MAPT P10636 2/20 0.31
GAA P10253 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
SCHEMBL15340294 0.83 CYP2C9 (0.33) OPRL1CYP2C9MAPTGAA
SCHEMBL15340010 0.81 RAB9A (0.40) RAB9ACYP2C9
SCHEMBL15340292 0.81 SPHK1 (0.39) OPRL1CYP2C9
SCHEMBL15340285 0.79 OPRL1 (0.34) OPRL1MAPTGAA
SCHEMBL15343911 0.79 RAB9A (0.35) RAB9ACYP2C9MAPT
SCHEMBL15340288 0.78 KDM4E (0.32) MAPT
SCHEMBL15343571 0.77 RAB9A (0.37) RAB9ACYP2C9
SCHEMBL15340301 0.77 CYP2C9 (0.37) OPRL1CYP2C9MAPT
SCHEMBL8455532 0.77 RAB9A (0.45) RAB9ACYP2C9MAPTGAA
SCHEMBL1890879 0.77 RAB9A (0.45) RAB9ACYP2C9MAPTGAA

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
US-9102871-B2 Liquid crystal compound showing negative dielectric anisotropy, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-08-11 US disclosed
US-20130277610-A1 LIQUID CRYSTAL COMPOUND SHOWING NEGATIVE DIELECTRIC ANISOTROPY, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-10-24 US disclosed