SCHEMBL8958719

SCHEMBL8958719

CCCCCCCCCCc1ccc(-c2ccc(-c3ccc(C4CCC(C5CCC(CCC)CC5)CC4)cc3F)cc2)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.37
SPHK1 Q9NYA1 11/20 0.34
CYP2C9 P11712 2/20 0.34
CYP3A4 P08684 1/20 0.33
FASN P49327 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
APP P05067 1/20 0.31
SPHK2 Q9NRA0 5/20 0.31

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
SCHEMBL8958693 1.00 RARB (0.37) RARBSPHK1CYP2C9CYP3A4FASN
SCHEMBL8958733 1.00 RARB (0.37) RARBSPHK1CYP2C9CYP3A4FASN
SCHEMBL8958712 1.00 RARB (0.37) RARBSPHK1CYP2C9CYP3A4FASN
SCHEMBL8958907 1.00 RARB (0.37) RARBSPHK1CYP2C9CYP3A4FASN
SCHEMBL8958581 0.99 RARB (0.35) RARBSPHK1CYP2C9CYP3A4FASN
SCHEMBL8932904 0.97 RARB (0.39) RARBSPHK1CYP2C9CYP3A4FASN
SCHEMBL8932834 0.97 RARB (0.39) RARBSPHK1CYP2C9CYP3A4FASN
SCHEMBL8932855 0.97 RARB (0.39) RARBSPHK1CYP2C9CYP3A4FASN
SCHEMBL8932820 0.97 RARB (0.39) RARBSPHK1CYP2C9CYP3A4FASN
SCHEMBL8932818 0.97 RARB (0.39) RARBSPHK1CYP2C9CYP3A4FASN

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-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE KIF23, HCN3, FZD7 RARB 3042/4885SPHK1 2159/4885CYP2C9 2391/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.