Sugi Predict

Sugi Predict / Compounds / SCHEMBL9516247

SCHEMBL9516247

SCHEMBL9516247

CNC(=O)C(CO)NCc1ccc(OCc2cccc(OC)c2)cc1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 6/20 0.52
▸ BCHE P06276 1/20 0.49
▸ MAOA P21397 1/20 0.48
▸ SCN9A Q15858 1/20 0.48
▸ FFAR1 O14842 2/20 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
SCHEMBL7399641 1.00 MAOB (0.52) MAOBBCHEMAOASCN9AFFAR1
SCHEMBL9129480 0.88 MAOB (0.53) MAOBMAOASCN9AFFAR1
SCHEMBL7396393 0.88 MAOB (0.53) MAOBMAOASCN9AFFAR1
SCHEMBL3061396 0.87 MAOB (0.54) MAOBMAOASCN9A
SCHEMBL7398478 0.87 MAOB (0.65) MAOBMAOASCN9A
SCHEMBL1068001 0.87 MAOB (0.65) MAOBMAOASCN9A
SCHEMBL7395180 0.87 MAOB (0.54) MAOBMAOASCN9A
SCHEMBL8935277 0.86 MMP9 (0.60) BCHE
SCHEMBL8935472 0.86 MMP9 (0.60) BCHE
SCHEMBL1071045 0.86 MMP9 (0.60) BCHE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0400495-B1 N-phenylalkyl substituted alpha-amino carboxamide derivatives and process for their preparation. ERBA CARLO SPA (IT) 1993-11-03 — — EP disclosed
EP-0400495-A1 N-phenylalkyl substituted alfa-amino carboxamide derivatives and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1990-12-05 — — EP disclosed