SCHEMBL12735233

SCHEMBL12735233

C=CCCOc1ccc(C2CCC(CCc3ccc(-c4ccc(C)cc4)c(F)c3F)CC2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.35
MOGAT2 Q3SYC2 3/20 0.35
FFAR4 Q5NUL3 2/20 0.33
KDM1A O60341 1/20 0.31
OPRL1 P41146 2/20 0.30
DGAT1 O75907 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
SCHEMBL12735238 0.96 CYP2C9 (0.34) CYP2C9MOGAT2FFAR4KDM1A
SCHEMBL12739925 0.94 CYP2C9 (0.35) CYP2C9MOGAT2FFAR4KDM1A
SCHEMBL14766277 0.92 FFAR4 (0.34) CYP2C9MOGAT2FFAR4
SCHEMBL14765786 0.92 FFAR4 (0.36) FFAR4
SCHEMBL12735232 0.91 FFAR4 (0.33) CYP2C9MOGAT2FFAR4KDM1AOPRL1
SCHEMBL12739927 0.90 CYP2C9 (0.35) CYP2C9MOGAT2FFAR4KDM1A
SCHEMBL12735214 0.89 CYP2C9 (0.36) CYP2C9MOGAT2FFAR4KDM1AOPRL1
SCHEMBL12821332 0.89 ACACA (0.33) FFAR4
SCHEMBL14765782 0.89 FFAR4 (0.34) FFAR4
SCHEMBL12733967 0.88 CYP2C9 (0.35) CYP2C9MOGAT2FFAR4KDM1A

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 CYP2C9 2816/4885MOGAT2 992/4885FFAR4 546/4885

“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.