SCHEMBL12625971

SCHEMBL12625971

CCCCCC1CCC(c2ccc(-c3ccc(-c4cc(F)c(C(F)(F)Oc5cc(F)c(C(F)(F)F)c(F)c5)c(F)c4)c(F)c3)cc2)CC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 1/20 0.33
CYP2C9 P11712 2/20 0.32
CYP3A4 P08684 1/20 0.32
APP P05067 1/20 0.32
FASN P49327 1/20 0.32
DGAT1 O75907 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
SCHEMBL1815077 0.94 CYP2C9 (0.32) P2RY14CYP2C9CYP3A4APP
SCHEMBL12625975 0.94 FASN (0.35) CYP2C9CYP3A4APPFASN
SCHEMBL2398862 0.94 FASN (0.34) FASN
SCHEMBL12625818 0.94 P2RY14 (0.32) P2RY14CYP2C9CYP3A4APPDGAT1
SCHEMBL12625808 0.94 P2RY14 (0.32) P2RY14CYP2C9CYP3A4APPDGAT1
SCHEMBL12625811 0.94 P2RY14 (0.32) P2RY14CYP2C9CYP3A4APPDGAT1
SCHEMBL12625805 0.94 P2RY14 (0.32) P2RY14CYP2C9CYP3A4APPDGAT1
SCHEMBL12625813 0.94 P2RY14 (0.32) P2RY14CYP2C9CYP3A4APPDGAT1
SCHEMBL12625810 0.94 P2RY14 (0.32) P2RY14CYP2C9CYP3A4APPDGAT1
SCHEMBL12625812 0.94 P2RY14 (0.32) P2RY14CYP2C9CYP3A4APPDGAT1

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-7951433-B2 Five-ring liquid crystal compound having CF2O bonding group, liquid crystal composition, and liquid crystal display device CHISSO CORPORATION (JP) 2011-05-31 US disclosed
US-20100127211-A1 FIVE-RING LIQUID CRYSTAL COMPOUND HAVING CF20 BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-05-27 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-20100127211-A1 FIVE-RING LIQUID CRYSTAL COMPOUND HAVING CF20 BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CFAP20, KIF20A, KIF20B P2RY14 1191/4885CYP2C9 827/4885CYP3A4 1387/4885

“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.