SCHEMBL12735083

SCHEMBL12735083

COc1ccc(C2CCC(CCc3ccc(-c4ccc(CO)cc4)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 3/20 0.34
FEN1 P39748 3/20 0.34
FFAR4 Q5NUL3 4/20 0.34
FPR2 P25090 2/20 0.33
FYN P06241 1/20 0.31
CHEK1 O14757 1/20 0.31
S1PR1 P21453 1/20 0.31
CHKA P35790 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
SCHEMBL12739813 1.00 ALOX5AP (0.34) ALOX5APFEN1FFAR4FPR2FYN
SCHEMBL12716381 0.92 FPR2 (0.33) ALOX5APFEN1FFAR4FPR2CHKA
SCHEMBL12739802 0.92 FPR2 (0.33) ALOX5APFEN1FFAR4FPR2CHKA
SCHEMBL12739814 0.91 FFAR4 (0.36) ALOX5APFEN1FFAR4FPR2S1PR1
SCHEMBL12735085 0.91 FFAR4 (0.36) ALOX5APFEN1FFAR4FPR2S1PR1
SCHEMBL12822546 0.90 ALOX5AP (0.33) ALOX5APFEN1FFAR4FPR2
SCHEMBL12821320 0.90 ALOX5AP (0.33) ALOX5APFEN1FFAR4FPR2
SCHEMBL12739803 0.89 FFAR4 (0.36) FFAR4
SCHEMBL12735071 0.89 FFAR4 (0.36) FFAR4
SCHEMBL12733874 0.88 ALOX5AP (0.41) ALOX5APFEN1FFAR4FPR2FYN

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 ALOX5AP 1673/4885FEN1 3340/4885FFAR4 546/4885

“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.