SCHEMBL8932623

SCHEMBL8932623

CCCCCC1CCC(O)(c2ccc(-c3ccc(-c4ccc(OCC)c(F)c4F)cc3)c(F)c2)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 8/20 0.35
CYP2C9 P11712 5/20 0.35
SSTR5 P35346 1/20 0.34
CYP3A4 P08684 5/20 0.34
CYP2C19 P33261 5/20 0.34
CYP2D6 P10635 3/20 0.34
RARB P10826 1/20 0.32
RORC P51449 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
CYP1A2 P05177 1/20 0.32
ESR1 P03372 1/20 0.32
HPGD P15428 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRK1 P41145 1/20 0.31
OPRL1 P41146 1/20 0.31
FGFR2 P21802 1/20 0.31
AKR1B10 O60218 1/20 0.31
AKR1C4 P17516 1/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 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
SCHEMBL8932635 0.86 FFAR4 (0.32) RARBFFAR4ESR1
SCHEMBL8932589 0.80 KDM1A (0.38) APPCYP2C9CYP3A4CYP2C19CYP2D6
SCHEMBL8932755 0.79 FFAR4 (0.39) SSTR5FFAR4
SCHEMBL8932587 0.79 KDM1A (0.37) APPCYP2C9CYP3A4CYP2C19CYP2D6
SCHEMBL8932601 0.78 FFAR4 (0.33) CYP3A4RARBFFAR4OPRM1OPRK1
SCHEMBL8932793 0.78 GRM2 (0.35) SSTR5FFAR4FGFR2
SCHEMBL8958831 0.78 KDM1A (0.36) APPCYP2C9CYP3A4CYP2C19CYP2D6
SCHEMBL10798909 0.78 OPRM1 (0.39) CYP1A2OPRM1OPRK1OPRL1
SCHEMBL9505513 0.77 OPRM1 (0.36) CYP2C9CYP3A4CYP2C19CYP2D6CYP1A2
SCHEMBL8932660 0.77 FPR2 (0.31) FFAR4

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 APP 2488/4885CYP2C9 2391/4885SSTR5 891/4885

“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.