SCHEMBL12907670

SCHEMBL12907670

CCc1ccc(OCc2ccc(-c3ccc(C4CO4)c(F)c3F)cc2)cc1F

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 2/20 0.38
▸ MAOB P27338 7/20 0.38
▸ GRM5 P41594 1/20 0.38
▸ FFAR1 O14842 6/20 0.37
▸ MAOA P21397 3/20 0.37
▸ S1PR1 P21453 2/20 0.37
▸ S1PR5 Q9H228 2/20 0.37
▸ FFAR4 Q5NUL3 1/20 0.36
▸ PRKX P51817 1/20 0.36
▸ IKBKE Q14164 1/20 0.36
▸ STAT3 P40763 1/20 0.35
▸ NAAA Q02083 1/20 0.35

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
SCHEMBL10303339 0.94 MAOB (0.37) F10MAOBGRM5FFAR1MAOA
SCHEMBL12907723 0.93 FFAR1 (0.37) F10MAOBGRM5FFAR1MAOA
SCHEMBL13586513 0.88 F10 (0.38) F10MAOBGRM5FFAR1MAOA
SCHEMBL12907023 0.88 GYS1 (0.39) MAOBFFAR1S1PR1FFAR4
SCHEMBL12908518 0.87 FFAR4 (0.36) MAOBFFAR1MAOAFFAR4
SCHEMBL12908284 0.85 FFAR1 (0.40) F10MAOBFFAR1NAAA
SCHEMBL13586515 0.84 FFAR1 (0.39) F10MAOBGRM5FFAR1MAOA
SCHEMBL12822769 0.84 FFAR1 (0.43) F10MAOBFFAR1
SCHEMBL12823794 0.84 FFAR4 (0.37) MAOBFFAR1FFAR4
SCHEMBL12823408 0.84 FFAR4 (0.37) MAOBFFAR1FFAR4

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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-02-17 — — US disclosed
WO-2009125668-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE チッソ株式会社 (JP) 2009-10-15 — — WO 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-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, L3MBTL3 F10 737/4885MAOB 3725/4885GRM5 3613/4885

“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.

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