SCHEMBL962597

SCHEMBL962597

NC(=O)CNCc1ccc(OCc2cccc(Cl)c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GID4 Q8IVV7 1/20 0.73
SPHK2 Q9NRA0 1/20 0.67
SPHK1 Q9NYA1 1/20 0.67
MAOB P27338 4/20 0.60
RXRA P19793 1/20 0.59
RXRB P28702 1/20 0.59
RXRG P48443 1/20 0.59
SCN3A Q9NY46 1/20 0.58
MAOA P21397 1/20 0.57
ALOX5 P09917 1/20 0.56

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
Hydrochloric Acid SCHEMBL9127887 0.99 GID4 (0.71) GID4SPHK2SPHK1MAOBRXRA
SCHEMBL964037 0.90 SPHK2 (0.67) GID4SPHK2SPHK1MAOBRXRA
SCHEMBL7396470 0.89 GID4 (0.78) GID4SPHK2SPHK1MAOBRXRA
SCHEMBL9517449 0.88 GID4 (0.64) GID4SPHK2SPHK1MAOBRXRA
SCHEMBL69355 0.88 MAOB (0.60) GID4SPHK2SPHK1MAOBRXRA
SCHEMBL7401139 0.85 GID4 (0.77) GID4MAOBRXRARXRBRXRG
SCHEMBL963386 0.85 SPHK2 (0.67) SPHK2SPHK1MAOBSCN3AMAOA
SCHEMBL9460359 0.84 GID4 (0.69) GID4MAOBRXRARXRBRXRG
SCHEMBL7391510 0.84 SPHK2 (0.82) GID4SPHK2SPHK1SCN3A
SCHEMBL9903566 0.84 HDAC1 (0.56) GID4SPHK2SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222290-B1 ALPHA-AMINOAMIDE DERIVATIVES FOR THE TREATMENT OF PSYCHIATRIC DISORDERS NEWRON PHARM SPA (IT) 2021-06-16 EP claimed
US-8445539-B2 Alpha-aminoamide derivatives useful in the treatment of psychiatric disorders NEWRON PHARMACEUTICALS S.P.A. (IT) 2013-05-21 US claimed
CN-102274517-A Methods for treatment of parkinson's disease 2011-12-14 CN claimed
US-20110014304-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF PSYCHIATRIC DISORDERS NEWRON PHARMACEUTICALS S.P.A. (IT) 2011-01-20 US claimed
EP-2222290-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF PSYCHIATRIC DISORDERS Newron Pharmaceuticals S.p.A. (IT) 2010-09-01 EP claimed
WO-2009080470-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF PSYCHIATRIC DISORDERS NEWRON PHARMACEUTICALS S.P.A. (IT) 2009-07-02 WO 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
EP-0400495-B1 N-phenylalkyl substituted alpha-amino carboxamide derivatives and process for their preparation. ERBA CARLO SPA (IT) 1993-11-03 EP claimed
US-5236957-A Antiepileptic agents FARMITALIA CARLO ERBA SRL (IT) 1993-08-17 US claimed
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 claimed
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 claimed
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 claimed
EP-2222290-B1 ALPHA-AMINOAMIDE DERIVATIVES FOR THE TREATMENT OF PSYCHIATRIC DISORDERS NEWRON PHARM SPA (IT) 2021-06-16 EP disclosed
US-9492410-B2 Methods for treatment of Parkinson's disease NEWRON PHARMACEUTICALS S.P.A. (IT) 2016-11-15 US 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 (2 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 GID4 2385/4885SPHK2 1573/4885SPHK1 2187/4885
US-20110014304-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF PSYCHIATRIC DISORDERS GABBR1, GABBR2, GABRA5 GID4 689/4885SPHK2 4354/4885SPHK1 4298/4885

“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.