SCHEMBL15340280

SCHEMBL15340280

CCCCOc1ccc(C2CCC(c3ccc(C4CCC(CCC)CC4)c(F)c3C(F)F)CO2)cc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.33
HRH3 Q9Y5N1 3/20 0.31
KCNH2 Q12809 2/20 0.31
CRBN Q96SW2 1/20 0.31
CYP2C9 P11712 2/20 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
SCHEMBL15343911 0.93 RAB9A (0.35) RAB9AHRH3KCNH2CRBNCYP2C9
SCHEMBL15343819 0.89 RAB9A (0.35) RAB9AHRH3KCNH2CRBNCYP2C9
SCHEMBL15343652 0.88 CYP2C9 (0.34) CYP2C9
SCHEMBL15340005 0.87 RAB9A (0.35) RAB9AHRH3KCNH2CRBNCYP2C9
SCHEMBL15343573 0.86 RAB9A (0.35) RAB9AHRH3KCNH2CRBNCYP2C9
SCHEMBL15343581 0.86 RAB9A (0.35) RAB9AHRH3KCNH2CRBNCYP2C9
SCHEMBL15340313 0.84 VEGFA (0.31)
SCHEMBL15340279 0.83 SPHK1 (0.33)
SCHEMBL15343651 0.83 FPR2 (0.34) RAB9AHRH3KCNH2CRBNCYP2C9
SCHEMBL15343834 0.83 TP53 (0.30)

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
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-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
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