SCHEMBL13586486

SCHEMBL13586486

C=CC1CCC(c2ccc(-c3ccc(C(=O)Oc4ccc(C5CO5)cc4F)cc3)c(F)c2F)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 2/20 0.33
▸ FEN1 P39748 2/20 0.33

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
SCHEMBL12823993 0.90 ALOX5AP (0.34) ALOX5APFEN1
SCHEMBL12716292 0.89 ALOX5AP (0.36) ALOX5APFEN1
SCHEMBL12719684 0.89 ALOX5AP (0.36) ALOX5APFEN1
SCHEMBL12823460 0.87 ALOX5AP (0.37) ALOX5APFEN1
SCHEMBL13586454 0.86 ALOX5AP (0.37) ALOX5APFEN1
SCHEMBL12822936 0.86 ALOX5AP (0.35) ALOX5APFEN1
SCHEMBL12719512 0.85 CYP2C9 (0.37) ALOX5APFEN1
SCHEMBL12823369 0.84 HIF1A (0.30) —
SCHEMBL13586433 0.84 SLC6A2 (0.33) ALOX5APFEN1
SCHEMBL12823452 0.84 ALOX5AP (0.33) ALOX5APFEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 — — WO disclosed
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