SCHEMBL8775452

SCHEMBL8775452

CCCc1ccc(C=Cc2ccc(CCC3CCC(CCC)CC3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.49
MAOA P21397 1/20 0.49
HRH3 Q9Y5N1 1/20 0.36
CYP2C9 P11712 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
LPL P06858 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
TNNC1 P63316 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MITF O75030 1/20 0.33
HPGD P15428 1/20 0.33
KLF5 Q13887 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL8015675 0.92 ALOX5 (0.41) MAOBMAOAHRH3CYP2C9GPR84
SCHEMBL8015686 0.92 ALOX5 (0.41) MAOBMAOAHRH3CYP2C9GPR84
SCHEMBL8015678 0.92 ALOX5 (0.41) MAOBMAOAHRH3CYP2C9GPR84
SCHEMBL8015681 0.92 ALOX5 (0.41) MAOBMAOAHRH3CYP2C9GPR84
SCHEMBL8775066 0.90 SPHK1 (0.41) MAOBMAOAHRH3CYP2C9ALDH1A1
SCHEMBL11058080 0.89 MAOB (0.57) MAOBMAOAHRH3CYP2C9GPR84
SCHEMBL11058086 0.89 MAOB (0.57) MAOBMAOAHRH3CYP2C9GPR84
SCHEMBL8447253 0.89 MAOB (0.46) MAOBMAOAALDH1A1KDM4E
SCHEMBL8447255 0.89 MAOB (0.46) MAOBMAOAALDH1A1KDM4E
SCHEMBL8447249 0.89 MAOB (0.46) MAOBMAOAALDH1A1KDM4E

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