SCHEMBL13586276

SCHEMBL13586276

CC(O)C1CCC(c2ccc(-c3ccc(OCc4ccc(C5CO5)c(F)c4)cc3)c(F)c2F)CC1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 8/20 0.37
▸ FFAR1 O14842 2/20 0.37
▸ NR1H4 Q96RI1 1/20 0.36
▸ ALOX5AP P20292 1/20 0.35
▸ FEN1 P39748 1/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ KDM5A P29375 1/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ BRD4 O60885 1/20 0.34
▸ GYS1 P13807 4/20 0.34
▸ F10 P00742 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
SCHEMBL13586394 0.94 FFAR1 (0.41) FFAR4FFAR1NR1H4ALOX5APFEN1
SCHEMBL12719392 0.91 FFAR1 (0.35) FFAR4FFAR1NR1H4ALOX5APFEN1
SCHEMBL13586613 0.88 BRD4 (0.36) FFAR4BRD4
SCHEMBL13586289 0.87 FFAR4 (0.36) FFAR4FFAR1NR1H4ALOX5APFEN1
SCHEMBL12823835 0.87 FFAR4 (0.36) FFAR4FFAR1NR1H4ALOX5APFEN1
SCHEMBL12823849 0.86 FFAR1 (0.36) FFAR4FFAR1NR1H4MAOAMAOB
SCHEMBL12823255 0.85 PPARD (0.42) FFAR4FFAR1GYS1
SCHEMBL13586284 0.85 FFAR4 (0.35) FFAR4FFAR1NR1H4ALOX5APFEN1
SCHEMBL13586476 0.85 FFAR1 (0.38) FFAR4FFAR1NR1H4ALOX5APFEN1
SCHEMBL12823837 0.85 FFAR4 (0.35) FFAR4NR1H4ALOX5APFEN1MAOA

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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