SCHEMBL12739802

SCHEMBL12739802

CCc1ccc(-c2ccc(C3CCC(CCc4ccc(OC)c(F)c4F)CC3)c(F)c2F)cc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.33
FFAR4 Q5NUL3 3/20 0.33
ALOX5AP P20292 3/20 0.32
FEN1 P39748 3/20 0.32
CHKA P35790 1/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL12716381 1.00 FPR2 (0.33) FPR2FFAR4ALOX5APFEN1CHKA
SCHEMBL12739813 0.92 ALOX5AP (0.34) FPR2FFAR4ALOX5APFEN1CHKA
SCHEMBL12735083 0.92 ALOX5AP (0.34) FPR2FFAR4ALOX5APFEN1CHKA
SCHEMBL12716395 0.92 FFAR4 (0.35) FPR2FFAR4ALOX5APFEN1CHKA
SCHEMBL12739804 0.92 FFAR4 (0.35) FPR2FFAR4ALOX5APFEN1CHKA
SCHEMBL12735071 0.91 FFAR4 (0.36) FFAR4
SCHEMBL12739803 0.91 FFAR4 (0.36) FFAR4
SCHEMBL12822546 0.90 ALOX5AP (0.33) FPR2FFAR4ALOX5APFEN1
SCHEMBL12821320 0.90 ALOX5AP (0.33) FPR2FFAR4ALOX5APFEN1
SCHEMBL12739790 0.89 CHKA (0.33) FFAR4ALOX5APFEN1CHKA

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 5 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-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
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
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 WO 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 FPR2 589/4885FFAR4 546/4885ALOX5AP 1673/4885

“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.