SCHEMBL8015686

SCHEMBL8015686

CCCC1CCC(CCc2ccc(C=Cc3ccc(CC)cc3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
MAOB P27338 4/20 0.41
MAOA P21397 1/20 0.41
TUBB1 Q9H4B7 1/20 0.40
TAAR1 Q96RJ0 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP2C9 P11712 1/20 0.34
CASP3 P42574 1/20 0.34

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 1.00 ALOX5 (0.41) ALOX5PTGS1PTGS2MAOBMAOA
SCHEMBL8015678 1.00 ALOX5 (0.41) ALOX5PTGS1PTGS2MAOBMAOA
SCHEMBL8015681 1.00 ALOX5 (0.41) ALOX5PTGS1PTGS2MAOBMAOA
SCHEMBL8775452 0.92 MAOB (0.49) MAOBMAOAHRH3KDM4ELMNA
SCHEMBL8775428 0.90 ALOX5 (0.41) ALOX5PTGS1PTGS2MAOBMAOA
SCHEMBL9059518 0.90 MAOB (0.47) MAOBMAOATAAR1HRH3MEN1
SCHEMBL9059515 0.90 MAOB (0.47) MAOBMAOATAAR1HRH3MEN1
SCHEMBL8775066 0.89 SPHK1 (0.41) MAOBMAOAHRH3NPC1RAB9A
SCHEMBL9477234 0.86 MAOB (0.40) MAOBMAOAHRH3CYP2C9GPR84
SCHEMBL9477243 0.86 MAOB (0.40) MAOBMAOAHRH3CYP2C9GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0805134-B1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORP (JP) 2000-08-30 EP disclosed
EP-0704512-B1 A liquid crystal composition and a liquid crystal display element using the same CHISSO CORP (JP) 2000-03-08 EP disclosed
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
EP-0704512-A1 A liquid crystal composition and a liquid crystal display element using the same Chisso Corporation (JP) 1996-04-03 EP disclosed