SCHEMBL8449335

SCHEMBL8449335

CCCc1ccc(-c2ccc(CCC3CCC(C/C=C/CF)CC3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.43
MAOA P21397 1/20 0.43
GPR84 Q9NQS5 1/20 0.36
NISCH Q9Y2I1 1/20 0.33
MCL1 Q07820 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
KCNH2 Q12809 1/20 0.30

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
SCHEMBL8453642 0.92 GPR84 (0.36) MAOBMAOAGPR84HRH3KCNH2
SCHEMBL8454385 0.91 HRH3 (0.40) HRH3
SCHEMBL8456546 0.87 MAOB (0.44) MAOBGPR84KCNH2
SCHEMBL8454721 0.86 SPHK1 (0.41)
SCHEMBL8448784 0.86 GPR84 (0.36) MAOBGPR84KCNH2
SCHEMBL8453293 0.86 MAOB (0.43) MAOBMAOAGPR84KCNH2
SCHEMBL8447595 0.84 GPR84 (0.34) MAOBGPR84
SCHEMBL8453370 0.83 CYP17A1 (0.40) MAOBGPR84HRH3
SCHEMBL8451584 0.83 GPR84 (0.36) MAOBGPR84
SCHEMBL8456193 0.81 GPR84 (0.38) MAOBGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0679707-B1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 1999-06-16 EP disclosed
US-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed
US-5653911-A Liquid crystalline compound liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1997-08-05 US disclosed
EP-0679707-A1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1995-11-02 EP disclosed