SCHEMBL12740792

SCHEMBL12740792

CCCCOc1ccc(OCC2CCC(c3ccc(-c4ccc(C)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 10/20 0.40
FFAR1 O14842 10/20 0.40
KDM1A O60341 2/20 0.39
FFAR4 Q5NUL3 4/20 0.35
PPARA Q07869 1/20 0.35
CYP2C9 P11712 2/20 0.35
MOGAT2 Q3SYC2 2/20 0.35
DGAT1 O75907 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
SCHEMBL12740794 0.98 PPARD (0.39) PPARDFFAR1KDM1AFFAR4PPARA
SCHEMBL12740795 0.97 PPARD (0.38) PPARDFFAR1KDM1AFFAR4PPARA
SCHEMBL12740796 0.97 PPARD (0.38) PPARDFFAR1KDM1AFFAR4PPARA
SCHEMBL12740798 0.97 PPARD (0.38) PPARDFFAR1KDM1AFFAR4PPARA
SCHEMBL12740757 0.96 FFAR1 (0.42) PPARDFFAR1KDM1AFFAR4PPARA
SCHEMBL14766560 0.95 FFAR1 (0.42) PPARDFFAR1KDM1AFFAR4PPARA
SCHEMBL12740758 0.94 FFAR1 (0.41) PPARDFFAR1KDM1AFFAR4PPARA
SCHEMBL12740762 0.94 FFAR1 (0.40) PPARDFFAR1KDM1AFFAR4PPARA
SCHEMBL12740760 0.94 FFAR1 (0.40) PPARDFFAR1KDM1AFFAR4PPARA
SCHEMBL12740761 0.94 FFAR1 (0.40) PPARDFFAR1KDM1AFFAR4PPARA

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 PPARD 3762/4885FFAR1 247/4885KDM1A 937/4885

“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.