SCHEMBL2185706

SCHEMBL2185706

CC(NCCc1ccc(OCc2ccccc2Cl)cc1)C(N)=O

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.59
MAOB P27338 6/20 0.55
MAOA P21397 3/20 0.52
NR4A2 P43354 1/20 0.50
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
TP53 P04637 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
ADAM17 P78536 1/20 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
SCHEMBL2186343 0.88 SCN9A (0.75) SCN9AMAOBMAOANR4A2TP53
SCHEMBL2187391 0.88 SCN9A (0.75) SCN9AMAOBMAOANR4A2TP53
SCHEMBL966440 0.88 SCN9A (0.75) SCN9AMAOBMAOANR4A2TP53
SCHEMBL964122 0.86 SCN9A (0.79) SCN9AMAOBMAOA
SCHEMBL69031 0.81 MAOB (0.60) SCN9AMAOBMAOA
SCHEMBL87713 0.80 MAOB (0.59) MAOBMAOANR4A2CYP1A2CYP3A4
SCHEMBL28564451 0.80 SCN9A (0.76) SCN9AMAOBMAOA
SCHEMBL28564453 0.80 SCN9A (0.76) SCN9AMAOBMAOA
SCHEMBL2185713 0.79 MAOB (0.54) SCN9AMAOBMAOANR4A2CYP1A2
SCHEMBL5188131 0.79 SCN9A (0.58) SCN9AMAOBMAOANR4A2CYP1A2

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 10 patents. 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-8741957-B2 Alpha-aminoamide derivatives useful in the treatment of cognitive disorders NEWRON PHARMACEUTICALS S.P.A. (IT) 2014-06-03 US claimed
EP-2222290-B1 ALPHA-AMINOAMIDE DERIVATIVES FOR THE TREATMENT OF PSYCHIATRIC DISORDERS NEWRON PHARM SPA (IT) 2021-06-16 EP disclosed
EP-2977046-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF COGNITIVE DISORDERS Newron Pharmaceuticals S.p.A. (IT) 2016-01-27 EP disclosed
US-8741957-B2 Alpha-aminoamide derivatives useful in the treatment of cognitive disorders NEWRON PHARMACEUTICALS S.P.A. (IT) 2014-06-03 US disclosed
EP-2343064-A1 Alpha-aminoamide derivatives useful in the treatment of cognitive disorders Newron Pharmaceuticals S.p.A. (IT) 2011-07-13 EP disclosed
US-20100016437-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF COGNITIVE DISORDERS NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-01-21 US disclosed
EP-2029130-A2 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF COGNITIVE DISORDERS Newron Pharmaceuticals S.p.A. (IT) 2009-03-04 EP disclosed
EP-1870097-A1 Alpha-aminoamide derivatives useful in the treatment of cognitive disorders Newron Pharmaceuticals S.p.A. (IT) 2007-12-26 EP disclosed
WO-2007144153-A2 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF COGNITIVE DISORDERS NEWRON PHARMACEUTICALS S.P.A. (IT) 2007-12-21 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 (1 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-20100016437-A1 ALPHA-AMINOAMIDE DERIVATIVES USEFUL IN THE TREATMENT OF COGNITIVE DISORDERS PSEN1, MAPT, AADAT SCN9A 3223/4885MAOB 709/4885MAOA 506/4885

“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.