SCHEMBL12739849

SCHEMBL12739849

CCCCCc1ccc(-c2ccc(C3CCC(CCc4ccc(OC)c(F)c4)CC3)c(F)c2F)cc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.37
FFAR4 Q5NUL3 2/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
LYPLA1 O75608 1/20 0.35
LYPLA2 O95372 1/20 0.35
ABHD16A O95870 1/20 0.35
HTR2A P28223 1/20 0.34

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
SCHEMBL12739990 0.94 LYPLA1 (0.36) RARBFFAR4LYPLA1LYPLA2ABHD16A
SCHEMBL12739854 0.92 FFAR4 (0.38) RARBFFAR4
SCHEMBL12739845 0.91 FFAR4 (0.36) FFAR4
SCHEMBL12739860 0.89 FFAR4 (0.38) FFAR4
SCHEMBL12718339 0.89 FFAR4 (0.37) FFAR4
SCHEMBL12739708 0.88 LYPLA1 (0.42) PPARGPPARALYPLA1LYPLA2ABHD16A
SCHEMBL12733910 0.88 SPHK1 (0.41) RARBFFAR4
SCHEMBL12740328 0.87 NAAA (0.45) RARBFFAR4PPARGPPARA
SCHEMBL12735071 0.87 FFAR4 (0.36) RARBFFAR4
SCHEMBL12739803 0.87 FFAR4 (0.36) RARBFFAR4

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 RARB 2705/4885FFAR4 546/4885PPARG 3918/4885

“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.