SCHEMBL12736014

SCHEMBL12736014

CCCCOc1ccc(C2CCC(COc3ccc(-c4ccc(C)cc4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 8/20 0.36
ALOX5AP P20292 6/20 0.36
KDM1A O60341 3/20 0.36
DGAT1 O75907 1/20 0.34
GRM2 Q14416 3/20 0.33
FFAR4 Q5NUL3 1/20 0.32
SCN9A Q15858 1/20 0.32
FPR2 P25090 2/20 0.32

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
SCHEMBL12740718 1.00 FEN1 (0.36) FEN1ALOX5APKDM1ADGAT1GRM2
SCHEMBL12736016 0.97 FEN1 (0.35) FEN1ALOX5APKDM1ADGAT1GRM2
SCHEMBL12740719 0.97 FEN1 (0.35) FEN1ALOX5APKDM1ADGAT1GRM2
SCHEMBL12740721 0.96 FEN1 (0.35) FEN1ALOX5APKDM1ADGAT1GRM2
SCHEMBL12736021 0.96 FEN1 (0.35) FEN1ALOX5APKDM1ADGAT1GRM2
SCHEMBL12736024 0.96 FEN1 (0.35) FEN1ALOX5APKDM1ADGAT1GRM2
SCHEMBL12740724 0.96 FEN1 (0.35) FEN1ALOX5APKDM1ADGAT1GRM2
SCHEMBL12736028 0.96 FEN1 (0.35) FEN1ALOX5APKDM1ADGAT1GRM2
SCHEMBL12740722 0.96 FEN1 (0.35) FEN1ALOX5APKDM1ADGAT1GRM2
SCHEMBL12733882 0.94 ALOX5AP (0.37) FEN1ALOX5APFFAR4SCN9AFPR2

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed
US-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 FEN1 3340/4885ALOX5AP 1673/4885KDM1A 937/4885

“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.