SCHEMBL10303264

SCHEMBL10303264

Cc1ccc(-c2ccc(-c3cccc(F)c3F)cn2)c(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.44
▸ WDR5 P61964 1/20 0.40
▸ FEN1 P39748 5/20 0.39
▸ ALOX5AP P20292 4/20 0.39
▸ IDO1 P14902 3/20 0.37
▸ GRIN2B Q13224 3/20 0.36
▸ GRIN1 Q05586 1/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ GSK3A P49840 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35
▸ DHODH Q02127 1/20 0.35
▸ CTSA P10619 1/20 0.35
▸ PGR P06401 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
SCHEMBL10303392 0.90 FEN1 (0.45) FEN1ALOX5APGRIN2BCYP11B1CYP11B2
SCHEMBL17359276 0.83 FEN1 (0.41) FEN1ALOX5APGRIN2B
SCHEMBL10303256 0.83 CNR2 (0.44) CNR2WDR5FEN1ALOX5APIDO1
SCHEMBL10303374 0.82 DHODH (0.47) CNR2FEN1ALOX5APCYP11B1CYP11B2
SCHEMBL10303348 0.80 PIM1 (0.42) FEN1ALOX5APIDO1PGR
SCHEMBL11953549 0.78 ACHE (0.41) WDR5DHODHCTSA
SCHEMBL10302705 0.78 GRM5 (0.37) —
SCHEMBL4402602 0.75 CCR1 (0.54) FEN1ALOX5APCYP11B1CYP11B2DHODH
SCHEMBL19154379 0.75 PTGS2 (0.45) FEN1ALOX5APGRIN2B
SCHEMBL13262957 0.73 PTPRC (0.44) DHODH

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-8216489-B2 Three-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-07-10 — — US disclosed
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

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 CNR2 2145/4885WDR5 1067/4885FEN1 2927/4885

“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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