SCHEMBL7499427

SCHEMBL7499427

CN(CC(=O)Nc1ccc(Cl)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
TP53 P04637 1/20 0.48
ALOX12 P18054 1/20 0.48
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
ATM Q13315 1/20 0.47
NPC1 O15118 1/20 0.46
TSHR P16473 1/20 0.46
POLB P06746 1/20 0.46
MCHR1 Q99705 1/20 0.46
PKM P14618 1/20 0.46
RAB9A P51151 1/20 0.46
HTT P42858 1/20 0.45

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
SCHEMBL19112868 0.87 GAA (0.52) ALDH1A1L3MBTL1KMT2ALMNATDP1
SCHEMBL17572297 0.86 GAA (0.42) ALDH1A1L3MBTL1MEN1KMT2ANPC1
SCHEMBL24629451 0.81 ALDH1A1 (0.58) ALDH1A1MEN1KMT2ALMNATSHR
SCHEMBL29769183 0.81 ALDH1A1 (0.58) ALDH1A1MEN1KMT2ALMNATSHR
SCHEMBL24630015 0.79 LMNA (0.46) ALDH1A1L3MBTL1MEN1KMT2ALMNA
SCHEMBL30118756 0.78 TRPV1 (0.41) ALDH1A1MEN1KMT2ALMNA
SCHEMBL4113034 0.78 AAK1 (0.44) MEN1KMT2A
SCHEMBL19675770 0.77 NLRP3 (0.50) ALDH1A1NPC1RAB9A
SCHEMBL23976270 0.77 KMT2A (0.57) ALDH1A1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL23099686 0.77 KMT2A (0.49) MEN1KMT2ALMNASMN1; SMN2ATM

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