SCHEMBL8935251

SCHEMBL8935251

CN(Cc1ccc(OCc2cccc(F)c2)cc1)C(=O)C(N)CO

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.58
PARP10 Q53GL7 1/20 0.58
MAOA P21397 2/20 0.56
SCN9A Q15858 1/20 0.54
NR4A2 P43354 1/20 0.53

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
SCHEMBL8935296 0.87 ALOX5 (0.60) MAOBMAOA
SCHEMBL8935376 0.86 MAOB (0.60) MAOBNR4A2
SCHEMBL8935310 0.81 MAOB (0.55) MAOBPARP10SCN9A
SCHEMBL4540328 0.79 MAOB (0.62) MAOBPARP10MAOASCN9ANR4A2
SCHEMBL9129876 0.79 MAOB (0.71) MAOBPARP10MAOASCN9ANR4A2
SCHEMBL7396562 0.79 MAOB (0.71) MAOBPARP10MAOASCN9ANR4A2
SCHEMBL8935232 0.78 FFAR1 (0.51)
SCHEMBL7398540 0.78 MAOB (0.55) MAOBPARP10MAOASCN9ANR4A2
SCHEMBL9129081 0.78 MAOB (0.55) MAOBPARP10MAOASCN9ANR4A2
SCHEMBL8935286 0.76 MAOB (0.54) MAOBMAOANR4A2

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