SCHEMBL15340303

SCHEMBL15340303

CCCCCC1CCC(c2ccc(-c3ccc(C4CCC(CCC)CO4)c(F)c3C)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.38
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
FASN P49327 1/20 0.35
GAA P10253 1/20 0.34
ESR2 Q92731 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
SCHEMBL15340062 0.85 FASN (0.35) FASN
SCHEMBL15340294 0.84 CYP2C9 (0.33) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL15340292 0.82 SPHK1 (0.39) CYP2C9
SCHEMBL2606304 0.81 CYP2C9 (0.36) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL10051627 0.81 CYP2C9 (0.42) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL2606424 0.81 CYP2C9 (0.42) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL10551847 0.81 FASN (0.45) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL10550184 0.81 FASN (0.45) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL10550182 0.81 FASN (0.45) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL10551851 0.81 FASN (0.45) CYP2C9MAPTALDH1A1LMNAMEN1

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