SCHEMBL7501629

SCHEMBL7501629

CN(C(=O)C1CCCN1)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 1/20 0.58
PFKFB2 O60825 1/20 0.46
PFKFB1 P16118 1/20 0.46
PFKFB3 Q16875 1/20 0.46
PDK2 Q15119 4/20 0.43
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
GHSR Q92847 2/20 0.41
HTR2C P28335 1/20 0.39
MLNR O43193 1/20 0.38
GLI1 P08151 1/20 0.37

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
SCHEMBL7501986 0.96 SCN4A (0.53) SCN4APFKFB2PFKFB1PFKFB3PDK2
SCHEMBL26364558 0.85 SCN4A (0.58) SCN4APFKFB2PFKFB1PFKFB3MLNR
SCHEMBL29517131 0.85 SCN4A (0.58) SCN4APFKFB2PFKFB1PFKFB3MLNR
SCHEMBL13723611 0.85 SCN4A (0.58) SCN4APFKFB2PFKFB1PFKFB3SLC6A3
SCHEMBL26364702 0.85 SCN4A (0.58) SCN4APFKFB2PFKFB1PFKFB3MLNR
SCHEMBL18580371 0.85 SCN4A (0.65) SCN4APFKFB2PFKFB1PFKFB3SLC6A2
SCHEMBL30715013 0.84 SCN4A (0.57) SCN4APFKFB2PFKFB1PFKFB3HTR2C
SCHEMBL15650741 0.81 SCN4A (0.53) SCN4APFKFB2PFKFB1PFKFB3SLC6A2
SCHEMBL26364480 0.81 SCN4A (0.53) SCN4APFKFB2PFKFB1PFKFB3MLNR
SCHEMBL27634766 0.81 SCN4A (0.53) SCN4APFKFB2PFKFB1PFKFB3SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0826673-B1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO (JP) 2002-11-20 EP disclosed
US-5972946-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1999-10-26 US disclosed
EP-0826673-A1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-03-04 EP disclosed