SCHEMBL8935303

SCHEMBL8935303

CNC(=O)C(N)(CO)Cc1ccc(OCc2cccc(Cl)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.54
MAOA P21397 3/20 0.54
ALOX5 P09917 1/20 0.53
PKM P14618 1/20 0.53
RXRA P19793 1/20 0.52
RXRB P28702 1/20 0.52
RXRG P48443 1/20 0.52
GID4 Q8IVV7 1/20 0.48
S1PR1 P21453 1/20 0.47
S1PR5 Q9H228 1/20 0.47

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
SCHEMBL8935258 0.87 MAOB (0.54) MAOBMAOA
SCHEMBL8935325 0.87 PKM (0.57) MAOBMAOAALOX5PKMRXRA
SCHEMBL8935449 0.86 MAOB (0.58) MAOBMAOAALOX5PKMRXRA
SCHEMBL8935383 0.85 MAOB (0.57) MAOBS1PR1S1PR5
SCHEMBL8935294 0.81 MAOB (0.51) MAOBMAOA
SCHEMBL7398078 0.80 MAOB (0.54) MAOBMAOAALOX5PKMRXRA
SCHEMBL8935237 0.80 MAOB (0.51) MAOBMAOAALOX5
SCHEMBL8935242 0.80 MAOB (0.51) MAOBMAOAALOX5
SCHEMBL8935328 0.78 PKM (0.61) MAOBMAOAALOX5PKMRXRA
SCHEMBL4422889 0.78 MAOB (0.60) MAOBMAOAALOX5PKMRXRA

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-5502079-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS FARMITALIA CARLO ERBA S.R.L. (IT) 1996-03-26 US disclosed