SCHEMBL4456855

SCHEMBL4456855

C[C@H](NCc1ccc(OCc2ccccc2)cc1)C(N)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.74
SCN9A Q15858 2/20 0.74
MAOA P21397 1/20 0.74
HRH3 Q9Y5N1 2/20 0.64
BCHE P06276 1/20 0.60

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
SCHEMBL7403715 1.00 MAOB (0.74) MAOBSCN9AMAOAHRH3BCHE
SCHEMBL1070615 1.00 MAOB (0.74) MAOBSCN9AMAOAHRH3BCHE
SCHEMBL7390166 0.96 SCN9A (0.70) MAOBSCN9AMAOAHRH3BCHE
SCHEMBL7390171 0.96 SCN9A (0.70) MAOBSCN9AMAOAHRH3BCHE
SCHEMBL23440921 0.89 MAOB (0.67) MAOBSCN9AMAOAHRH3
SCHEMBL23440991 0.88 MAOB (0.76) MAOBSCN9AMAOAHRH3
SCHEMBL23440948 0.88 MAOB (0.65) MAOBSCN9AMAOAHRH3
SCHEMBL1069302 0.88 MAOB (0.76) MAOBSCN9AMAOAHRH3
SCHEMBL23440930 0.88 MAOB (0.76) MAOBSCN9AMAOAHRH3
SCHEMBL2016084 0.88 MAOB (0.76) MAOBSCN9AMAOAHRH3

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102274517-A Methods for treatment of parkinson's disease 2011-12-14 CN claimed
EP-2070526-A1 \"Methods for treatment of Parkinson's disease\ Newron Pharmaceuticals S.p.A. (IT) 2009-06-17 EP claimed
US-20070093495-A1 Methods for treatment of parkinson's disease NEWRON PHARMACEUTICALS S.P.A. (IT) 2007-04-26 US claimed
CN-1771030-A Methods of treating Parkinson's disease NEWRON PHARMACEUTICALS INC (IT) 2006-05-10 CN claimed
EP-1613296-A2 METHODS FOR TREATMENT OF PARKINSON'S DISEASE Newron Pharmaceuticals S.p.A. (IT) 2006-01-11 EP claimed
WO-2004089353-A2 METHODS FOR TREATMENT OF PARKINSON'S DISEASE NEWRON PHARMACEUTICALS, S.P.A. (IT) 2004-10-21 WO claimed
US-10792257-B2 Pharmaceutical compositions comprising safinamide ZAMBON S.P.A. (IT) 2020-10-06 US disclosed
EP-3257842-A1 PROCESS FOR THE PRODUCTION OF 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO]PROPANAMIDES WITH HIGH PURITY DEGREE Newron Pharmaceuticals S.p.A. (IT) 2017-12-20 EP disclosed
EP-2229351-B1 PROCESS FOR THE PRODUCTION OF 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO]PROPANAMIDES WITH HIGH PURITY DEGREE NEWRON PHARM SPA (IT) 2017-11-08 EP disclosed
US-9492410-B2 Methods for treatment of Parkinson's disease NEWRON PHARMACEUTICALS S.P.A. (IT) 2016-11-15 US disclosed
EP-2474521-B1 High purity degree 2-[4-(3- and 2-fluorobenzyloxy)benzylamino]propanamides for use as medicaments and pharmaceutical formulations containing them NEWRON PHARM SPA (IT) 2016-08-10 EP disclosed
US-20150150833-A1 Methods For Treatment of Parkinson's Disease NEWRON PHARMACEUTICALS S.P.A. (IT) 2015-06-04 US disclosed
US-8901176-B2 Methods for treatment of Parkinson's disease NEWRON PHARMACEUTICALS, S.P.A. (IT) 2014-12-02 US disclosed
WO-2004089353-A2 METHODS FOR TREATMENT OF PARKINSON'S DISEASE NEWRON PHARMACEUTICALS, S.P.A. (IT) 2004-10-21 WO disclosed
US-5502079-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS FARMITALIA CARLO ERBA S.R.L. (IT) 1996-03-26 US disclosed
US-5391577-A Active on central nervous system; antiepileptic agents FARMITALIA CARLO ERBA S R L (IT) 1995-02-21 US disclosed
US-5236957-A Antiepileptic agents FARMITALIA CARLO ERBA SRL (IT) 1993-08-17 US disclosed
EP-0426816-A1 N-PHENYLALKYL SUBSTITUTED $g(a)-AMINO CARBOXAMIDE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1991-05-15 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
WO-1990014334-A1 N-PHENYLALKYL SUBSTITUTED α-AMINO CARBOXAMIDE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.R.L. (IT) 1990-11-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070093495-A1 Methods for treatment of parkinson's disease MAOB, MAOA, SNCA MAOB 1/4885SCN9A 2416/4885MAOA 2/4885
US-10792257-B2 Pharmaceutical compositions comprising safinamide TAS2R5, TAS2R42, TAS2R45 MAOB 1088/4885SCN9A 85/4885MAOA 1367/4885
US-20150150833-A1 Methods For Treatment of Parkinson's Disease MAOB, MAOA, SNCA MAOB 1/4885SCN9A 2416/4885MAOA 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.