SCHEMBL8726997

SCHEMBL8726997

C=CC1CCC(CCC2CCC(CCc3ccc(COCCC)cc3)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.36
MAOA P21397 1/20 0.36
HRH3 Q9Y5N1 2/20 0.33
GPR84 Q9NQS5 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL8726998 1.00 MAOB (0.36) MAOBMAOAHRH3GPR84TDP1
SCHEMBL8726994 1.00 MAOB (0.36) MAOBMAOAHRH3GPR84TDP1
SCHEMBL8731153 0.99 MAOB (0.36) MAOBMAOAHRH3GPR84TDP1
SCHEMBL8731156 0.99 MAOB (0.36) MAOBMAOAHRH3GPR84TDP1
SCHEMBL8730973 0.95 MAOB (0.34) MAOBMAOAHRH3GPR84TDP1
SCHEMBL8731231 0.95 GPR84 (0.36) MAOBMAOAHRH3GPR84TDP1
SCHEMBL8731237 0.95 GPR84 (0.36) MAOBMAOAHRH3GPR84TDP1
SCHEMBL8730980 0.95 MAOB (0.34) MAOBMAOAHRH3GPR84TDP1
SCHEMBL8730983 0.95 MAOB (0.34) MAOBMAOAHRH3GPR84TDP1
SCHEMBL8731048 0.91 HRH3 (0.37) MAOBMAOAHRH3TDP1L3MBTL1

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
EP-0882695-A1 BENZYL ETHER DERIVATIVES, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY CHISSO CORPORATION (JP) 1998-12-09 EP disclosed