SCHEMBL8775279

SCHEMBL8775279

CCCc1ccc(C#Cc2ccc(C#CC3CCC(CC)CC3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.52
FFAR4 Q5NUL3 2/20 0.47
ACACB O00763 9/20 0.46
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
PTGES O14684 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
PGK1 P00558 1/20 0.32
MGLL Q99685 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
SCHEMBL9499494 0.94 FFAR1 (0.50) FFAR1FFAR4ACACBMAOAMAOB
SCHEMBL9497050 0.94 FFAR1 (0.50) FFAR1FFAR4ACACBMAOAMAOB
SCHEMBL9497026 0.94 FFAR1 (0.50) FFAR1FFAR4ACACBMAOAMAOB
SCHEMBL9497038 0.94 FFAR1 (0.50) FFAR1FFAR4ACACBMAOAMAOB
SCHEMBL9499503 0.94 FFAR1 (0.50) FFAR1FFAR4ACACBMAOAMAOB
SCHEMBL8775086 0.90 FFAR1 (0.51) FFAR1FFAR4ACACBMAOAMAOB
SCHEMBL8775478 0.88 FFAR1 (0.48) FFAR1FFAR4ACACBPTGES
SCHEMBL9854903 0.87 FFAR1 (0.47) FFAR1FFAR4ACACBPTGESPGK1
SCHEMBL9496202 0.87 FFAR1 (0.47) FFAR1FFAR4ACACBPTGESPGK1
SCHEMBL9495021 0.86 FFAR1 (0.48) FFAR1FFAR4ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1169138-A Novel liquid crystal compound bearing dienyl moiety and liquid crystal composition CHISSO CORP (JP) 1997-12-31 CN disclosed
EP-0805134-A1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-11-05 EP disclosed