SCHEMBL12734331

SCHEMBL12734331

CCOc1ccc(C2CCC(/C=C/c3ccc(-c4ccc(CC)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 3/20 0.33
FFAR1 O14842 2/20 0.33
CAMKK1 Q8N5S9 1/20 0.32
CAMKK2 Q96RR4 1/20 0.32
TP53 P04637 1/20 0.31
HMOX1 P09601 1/20 0.31
PPARD Q03181 2/20 0.30
PPARA Q07869 1/20 0.30
NR1H4 Q96RI1 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 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
SCHEMBL14765855 0.94 FFAR4 (0.37) FFAR4FFAR1CAMKK1CAMKK2HMOX1
SCHEMBL12734337 0.94 FFAR4 (0.34) FFAR4FFAR1CAMKK1CAMKK2HMOX1
SCHEMBL12734332 0.93 FFAR4 (0.33) FFAR4FFAR1CAMKK1CAMKK2HMOX1
SCHEMBL12739284 0.93 FFAR4 (0.32) FFAR4FFAR1CAMKK1CAMKK2TP53
SCHEMBL13586337 0.92 LMNA (0.35) FFAR4FFAR1CAMKK1CAMKK2HMOX1
SCHEMBL12734340 0.92 FFAR4 (0.33) FFAR4FFAR1CAMKK1CAMKK2HMOX1
SCHEMBL12734334 0.90 FFAR4 (0.35) FFAR4FFAR1HMOX1
SCHEMBL14765734 0.90 FFAR4 (0.40) FFAR4FFAR1CAMKK1CAMKK2HMOX1
SCHEMBL12716432 0.89 FFAR4 (0.32) FFAR4FFAR1CAMKK1CAMKK2HMOX1
SCHEMBL14765904 0.89 FFAR4 (0.34) FFAR4FFAR1CAMKK1CAMKK2HMOX1

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 FFAR4 546/4885FFAR1 247/4885CAMKK1 1995/4885

“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.