SCHEMBL920177

SCHEMBL920177

CC(C)(NCc1ccc(OCc2ccccc2F)cc1)C(N)=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN3A Q9NY46 7/20 0.65
SCN9A Q15858 2/20 0.65
MAOB P27338 6/20 0.57
PARP15 Q460N3 2/20 0.57
PARP10 Q53GL7 2/20 0.57
PARP14 Q460N5 1/20 0.57
LPAR1 Q92633 1/20 0.47
LPAR5 Q9H1C0 1/20 0.47
KCNH2 Q12809 5/20 0.47
PTPN1 P18031 2/20 0.47
SCN1A P35498 1/20 0.47
SCN4A P35499 1/20 0.47
SCN7A Q01118 1/20 0.47
SCN5A Q14524 1/20 0.47
SCN2A Q99250 1/20 0.47
SCN8A Q9UQD0 1/20 0.47
SCN10A Q9Y5Y9 1/20 0.47
ALDH1A1 P00352 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2B6 P20813 1/20 0.46

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
Ralfinamide SCHEMBL5567624 0.91 SCN9A (0.82) SCN3ASCN9AMAOBPARP15PARP10
Ralfinamide SCHEMBL5567626 0.91 SCN9A (0.82) SCN3ASCN9AMAOBPARP15PARP10
SCHEMBL5185026 0.87 SCN3A (0.61) SCN3ASCN9AMAOBPARP15PARP10
SCHEMBL28404312 0.83 SCN3A (0.56) SCN3ASCN9AMAOBPARP15PARP10
SCHEMBL3064569 0.83 MAOB (0.58) SCN9AMAOBPARP10
SCHEMBL8935443 0.81 MAOB (0.60) SCN3ASCN9AMAOBPARP15PARP10
SCHEMBL7460590 0.80 SCN3A (0.71) SCN3ASCN9AMAOBPARP15PARP10
SCHEMBL1067948 0.80 MAOB (0.65) SCN9AMAOBPARP10
SCHEMBL5684437 0.80 SCN3A (0.55) SCN3ASCN9AMAOBPARP15PARP10
SCHEMBL964219 0.79 SCN3A (1.00) SCN3ASCN9AMAOBPARP15PARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2977046-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF COGNITIVE DISORDERS Newron Pharmaceuticals S.p.A. (IT) 2016-01-27 EP claimed
US-8697738-B2 Alpha-aminoamide derivatives useful in the treatment of addictive disorders NEWRON PHARMACEUTICALS S.P.A. (IT) 2014-04-15 US claimed
US-20130303568-A1 Substituted 2-Aminoacetamides and the Use Thereof PURDUE NEUROSCIENCE COMPANY (US) 2013-11-14 US claimed
US-20130217747-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF RESTLESS LEGS SYNDROME NEWRON PHARM SPA (US) 2013-08-22 US claimed
US-8426431-B2 Substituted 2-aminoacetamides and the use thereof PURDUE NEUROSCIENCE COMPANY (US) 2013-04-23 US claimed
EP-2201945-B1 Use of substituted 2-aminoacetamides for treating or ameliorating anxiety PURDUE NEUROSCIENCE COMPANY (US) 2013-03-06 EP claimed
EP-2201944-B1 Use of substituted 2-aminoacetamides for treating, preventing or ameliorating manic depression PURDUE NEUROSCIENCE COMPANY (US) 2012-05-23 EP claimed
EP-2343064-A1 Alpha-aminoamide derivatives useful in the treatment of cognitive disorders Newron Pharmaceuticals S.p.A. (IT) 2011-07-13 EP claimed
EP-1900362-B1 Alfa-aminoamide derivatives useful in the treatment of addictive disorders NEWRON PHARM SPA (IT) 2011-01-12 EP claimed
EP-1032377-B1 SUBSTITUTED 2-AMINOACETAMIDES AND THE USE THEREOF PURDUE NEUROSCIENCE COMPANY (US) 2010-11-17 EP claimed
EP-1557166-A1 Alpha-aminoamide derivatives useful in the treatment of lower urinary tract disorders Newron Pharmaceuticals S.p.A. (IT) 2005-07-27 EP claimed
WO-2005018627-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL AS ANTI-INFLAMMATORY AGENTS NEWRON PHARMACEUTICALS, SPA (IT) 2005-03-03 WO claimed
US-20030130295-A1 Substituted 2-aminoacetamides and the use thereof EURO-CELTIQUE S.A. 2003-07-10 US claimed
US-6479484-B1 SUBSTITUTED 2-AMINOACETAMIDES AND THE DISCOVERY THAT THESE COMPOUNDS ACT AS BLOCKERS OF SODIUM CHANNELS; PAIN RELIEVERS, TREATMENT OF ARRYTHMIA, LOCAL ANESTHETICS EURO-CELTIQUE S.A. (LU) 2002-11-12 US claimed
US-20020016464-A1 Substituted 2-aminoacetamides and the use thereof EURO-CELTIQUE S.A. 2002-02-07 US claimed
EP-0842143-B1 2-(4-SUBSTITUTED)-BENZYLAMINO-2-METHYL-PROPANAMIDE DERIVATIVES NEWRON PHARM SPA (IT) 2001-06-13 EP claimed
EP-1032377-A1 SUBSTITUTED 2-AMINOACETAMIDES AND THE USE THEREOF Euro-Celtique S.A. (LU) 2000-09-06 EP claimed
US-5945454-A 2-(4-substituted)-benzylamino-2-methyl-propanamide derivatives PHARMACIA & UPJOHN, S.P.A. (IT) 1999-08-31 US claimed
EP-0842143-A1 2-(4-SUBSTITUTED)-BENZYLAMINO-2-METHYL-PROPANAMIDE DERIVATIVES PHARMACIA & UPJOHN S.p.A. (IT) 1998-05-20 EP claimed
WO-1997005102-A1 2-(4-SUBSTITUTED)-BENZYLAMINO-2-METHYL-PROPANAMIDE DERIVATIVES PHARMACIA & UPJOHN S.P.A. (IT) 1997-02-13 WO claimed

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

For each of this compound's patents that has machine-readable text (4 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-20130303568-A1 Substituted 2-Aminoacetamides and the Use Thereof SLC1A2, GAP43, SCN2A SCN3A 17/4885SCN9A 80/4885MAOB 245/4885
US-20130217747-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF RESTLESS LEGS SYNDROME AADAT, PNMT, BCAT2 SCN3A 372/4885SCN9A 946/4885MAOB 53/4885
US-20020016464-A1 Substituted 2-aminoacetamides and the use thereof SLC1A2, SLC1A1, SCN2A SCN3A 14/4885SCN9A 90/4885MAOB 801/4885
US-20030130295-A1 Substituted 2-aminoacetamides and the use thereof SLC1A2, GAP43, SCN2A SCN3A 10/4885SCN9A 57/4885MAOB 718/4885

“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.