SCHEMBL12741014

SCHEMBL12741014

CCOc1ccc(OCc2ccc(-c3ccc(-c4ccc(CO)cc4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.49
PPARD Q03181 11/20 0.49
PPARA Q07869 2/20 0.41
PPARG P37231 1/20 0.41
FFAR4 Q5NUL3 1/20 0.40
MAOB P27338 1/20 0.39
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38

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
SCHEMBL12740980 0.95 FFAR1 (0.49) FFAR1PPARDPPARAPPARGMAOB
SCHEMBL12736564 0.94 FFAR1 (0.43) FFAR1PPARDFFAR4MAOBS1PR1
SCHEMBL14766865 0.94 FFAR1 (0.52) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL12741006 0.91 FFAR1 (0.47) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL12741015 0.90 FFAR1 (0.47) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL12823868 0.90 FFAR1 (0.47) FFAR1PPARDPPARA
SCHEMBL14767069 0.90 FFAR1 (0.54) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL12741007 0.89 FFAR1 (0.46) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL12741012 0.89 FFAR1 (0.48) FFAR1PPARDPPARAMAOB
SCHEMBL14766857 0.88 FFAR1 (0.47) FFAR1PPARDPPARAPPARGFFAR4

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 FFAR1 247/4885PPARD 3762/4885PPARA 3603/4885

“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.