SCHEMBL10303262

SCHEMBL10303262

CC(O)c1ccc(COc2ccc(-c3ccc(C4CO4)c(F)c3F)cc2)cc1F

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.35
▸ MAOA P21397 1/20 0.35
▸ GYS1 P13807 12/20 0.35
▸ FFAR1 O14842 3/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.34
▸ F10 P00742 1/20 0.33
▸ NR1H4 Q96RI1 1/20 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
SCHEMBL12907062 0.94 FFAR1 (0.37) MAOBMAOAFFAR1FFAR4F10
SCHEMBL12823849 0.87 FFAR1 (0.36) MAOBMAOAGYS1FFAR1FFAR4
SCHEMBL12907511 0.87 BRD4 (0.32) FFAR4
SCHEMBL12994821 0.84 FFAR4 (0.33) GYS1FFAR1FFAR4
SCHEMBL13586276 0.83 FFAR4 (0.37) MAOBMAOAGYS1FFAR1FFAR4
SCHEMBL12907756 0.83 FFAR1 (0.35) MAOBMAOAFFAR1F10NR1H4
SCHEMBL10303355 0.83 FFAR1 (0.42) GYS1FFAR1
SCHEMBL10303339 0.83 MAOB (0.37) MAOBMAOAGYS1FFAR1FFAR4
SCHEMBL12908518 0.82 FFAR4 (0.36) MAOBMAOAGYS1FFAR1FFAR4
SCHEMBL12994259 0.82 FFAR4 (0.33) FFAR4

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
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
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