SCHEMBL12836817

SCHEMBL12836817

CC(O)c1ccc(C2=CCC(OC(=O)c3ccc(-c4ccc(C5CO5)c(F)c4F)cc3F)CC2)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 2/20 0.31
▸ PIM1 P11309 2/20 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
SCHEMBL12836502 0.94 — —
SCHEMBL12836819 0.90 — —
SCHEMBL12836816 0.90 PIM1 (0.33) PIM1
SCHEMBL12836510 0.90 PIM1 (0.31) PIM1
SCHEMBL12836815 0.86 PIM1 (0.32) PIM1
SCHEMBL11939202 0.85 NAAA (0.35) NAAA
SCHEMBL12836503 0.85 — —
SCHEMBL12836808 0.84 NAAA (0.37) NAAA
SCHEMBL12836695 0.82 PIM1 (0.30) PIM1
SCHEMBL12223348 0.82 PIM1 (0.32) PIM1

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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