SCHEMBL12907755

SCHEMBL12907755

C/C=C/c1ccc(OCc2ccc(-c3ccc(C4CO4)c(F)c3F)cc2)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.34
▸ S1PR5 Q9H228 2/20 0.33
▸ KCNA3 P22001 1/20 0.33
▸ TUBB1 Q9H4B7 2/20 0.32
▸ F10 P00742 1/20 0.32
▸ ERN1 O75460 1/20 0.31
▸ PDCD1 Q15116 4/20 0.31
▸ CD274 Q9NZQ7 4/20 0.31
▸ PTPN1 P18031 2/20 0.31
▸ PTPN2 P17706 1/20 0.31
▸ ACP1 P24666 1/20 0.31
▸ S1PR4 O95977 1/20 0.31
▸ S1PR1 P21453 1/20 0.31
▸ S1PR3 Q99500 1/20 0.31
▸ AKR1C3 P42330 1/20 0.31
▸ BRD4 O60885 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
SCHEMBL13586325 0.91 FFAR4 (0.34) FFAR4KCNA3
SCHEMBL12822373 0.91 FFAR4 (0.34) FFAR4KCNA3
SCHEMBL12907056 0.89 S1PR5 (0.34) FFAR4S1PR5F10ERN1PDCD1
SCHEMBL12823911 0.87 FFAR4 (0.35) ALDH1A1MAPTMAPK1L3MBTL1FFAR4
SCHEMBL13653995 0.85 S1PR5 (0.38) FFAR4S1PR5F10PDCD1CD274
SCHEMBL10303299 0.84 CYP3A4 (0.33) —
SCHEMBL10303282 0.84 FFAR4 (0.33) FFAR4
SCHEMBL13586402 0.83 F10 (0.35) FFAR4KCNA3F10S1PR1S1PR3
SCHEMBL12906704 0.83 BRD4 (0.32) BRD4
SCHEMBL12994390 0.83 FFAR1 (0.41) MAPTPPARDPPARA

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 3 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
EP-2266941-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE Chisso Corporation (JP) 2010-12-29 — — EP 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 ALDH1A1 1806/4885MAPT 836/4885MAPK1 668/4885

“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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