SCHEMBL12836818

SCHEMBL12836818

CCOc1ccc(OCc2ccc(C3=CCC(c4ccc(C(C)O)c(F)c4F)CC3)cc2F)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 2/20 0.35
▸ PKM P14618 1/20 0.32

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
SCHEMBL11938893 0.95 NAAA (0.34) NAAA
SCHEMBL11943704 0.94 NAAA (0.31) NAAA
SCHEMBL11940028 0.93 NAAA (0.30) NAAA
SCHEMBL11939282 0.92 NAAA (0.31) NAAA
SCHEMBL15381825 0.92 NAAA (0.40) NAAAPKM
SCHEMBL11939317 0.90 PTGS1 (0.33) NAAA
SCHEMBL11933478 0.87 NAAA (0.37) NAAAPKM
SCHEMBL15381802 0.86 NAAA (0.36) NAAAPKM
SCHEMBL15381603 0.86 NAAA (0.39) NAAAPKM
SCHEMBL11939377 0.86 — —

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-2011033937-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2011-03-24 — — WO disclosed
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