SCHEMBL8447249

SCHEMBL8447249

CCCc1ccc(CC[C@H]2CC[C@H](CCc3ccc(/C=C/c4ccc(Cl)cc4)cc3)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.46
MAOA P21397 1/20 0.46
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
FAAH O00519 1/20 0.40
AHR P35869 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
KCNH2 Q12809 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
DRD2 P14416 2/20 0.35
DRD3 P35462 2/20 0.35
TAAR1 Q96RJ0 1/20 0.35

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
SCHEMBL8447255 1.00 MAOB (0.46) MAOBMAOAKDM4EALDH1A1POLB
SCHEMBL8447253 1.00 MAOB (0.46) MAOBMAOAKDM4EALDH1A1POLB
SCHEMBL8451082 0.92 DRD2 (0.43) MAOBMAOAKDM4EALDH1A1POLB
SCHEMBL8451086 0.92 DRD2 (0.43) MAOBMAOAKDM4EALDH1A1POLB
SCHEMBL8451091 0.92 DRD2 (0.43) MAOBMAOAKDM4EALDH1A1POLB
SCHEMBL8775452 0.89 MAOB (0.49) MAOBMAOAKDM4EALDH1A1
SCHEMBL8452519 0.89 MAOB (0.51) MAOBMAOAKDM4EALDH1A1POLB
SCHEMBL8452524 0.89 MAOB (0.51) MAOBMAOAKDM4EALDH1A1POLB
SCHEMBL8456020 0.86 MAOB (0.49) MAOBMAOAKDM4EALDH1A1POLB
SCHEMBL8456015 0.86 MAOB (0.49) MAOBMAOAKDM4EALDH1A1POLB

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
US-5858275-A Chlorobenzene derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1999-01-12 US disclosed