SCHEMBL8935372

SCHEMBL8935372

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

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 15/20 0.54
PARP10 Q53GL7 1/20 0.54
NR4A2 P43354 1/20 0.52
MAOA P21397 3/20 0.51
SCN9A Q15858 1/20 0.51

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
SCHEMBL8935253 0.85 MAOB (0.54) MAOBPARP10NR4A2MAOASCN9A
SCHEMBL8935329 0.81 MAOB (0.51) MAOBPARP10SCN9A
SCHEMBL8935363 0.80 MAOB (0.54) MAOBPARP10NR4A2MAOASCN9A
SCHEMBL8935241 0.78 MAOB (0.63) MAOBPARP10NR4A2MAOASCN9A
SCHEMBL8935293 0.77 MAOB (0.53) MAOBNR4A2MAOA
SCHEMBL8935396 0.77 MAOB (0.61) MAOBPARP10NR4A2MAOASCN9A
SCHEMBL8935258 0.74 MAOB (0.54) MAOBPARP10NR4A2MAOASCN9A
SCHEMBL3969640 0.73 MAOB (0.59) MAOBPARP10NR4A2MAOASCN9A
SCHEMBL8935444 0.73 RXRA (0.60) MAOBNR4A2MAOA
SCHEMBL8935358 0.72 MAOB (0.53) MAOBPARP10MAOA

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