SCHEMBL12740975

SCHEMBL12740975

CCCc1ccc(-c2ccc(-c3ccc(COc4ccc(OCC)c(F)c4)cc3)c(F)c2F)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 16/20 0.46
PPARD Q03181 9/20 0.46
PTGES O14684 1/20 0.42
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
MAOB P27338 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
SCHEMBL12741007 0.95 FFAR1 (0.46) FFAR1PPARDPTGESSENP8SENP7
SCHEMBL12740520 0.93 FFAR1 (0.46) FFAR1PPARDPTGESSENP8SENP7
SCHEMBL12740977 0.92 FFAR1 (0.44) FFAR1PPARDPTGESS1PR1S1PR3
SCHEMBL14767069 0.91 FFAR1 (0.54) FFAR1PPARDPTGESPPARGPPARA
SCHEMBL12740971 0.90 FFAR1 (0.47) FFAR1PPARDPTGESPPARGPPARA
SCHEMBL12717078 0.89 S1PR1 (0.41) FFAR1PPARDPTGESSENP8SENP7
SCHEMBL14767010 0.89 FFAR1 (0.47) FFAR1PPARDPTGESS1PR1S1PR3
SCHEMBL10302301 0.89 FFAR1 (0.41) FFAR1PPARDPTGESS1PR1S1PR3
SCHEMBL12740980 0.89 FFAR1 (0.49) FFAR1PPARDS1PR1S1PR3PPARG
SCHEMBL12740981 0.89 FFAR1 (0.47) FFAR1PPARDMAOB

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 4 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

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 3762/4885PTGES 4067/4885

“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.