SCHEMBL5167072

SCHEMBL5167072

CCN(CC)C(=O)c1cc(=O)cc(C)n1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.45
ALDH1A1 P00352 5/20 0.45
LMNA P02545 3/20 0.45
KDM4E B2RXH2 3/20 0.45
GAA P10253 1/20 0.45
CASP1 P29466 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TDP1 Q9NUW8 1/20 0.39
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
TP53 P04637 1/20 0.36
HSP90AA1 P07900 2/20 0.35
HSP90AB1 P08238 2/20 0.35
RECQL P46063 1/20 0.35
MAPT P10636 3/20 0.34
BRD4 O60885 1/20 0.33

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
SCHEMBL4163022 0.72 SPR (0.46) HPGDALDH1A1LMNAKDM4EGAA
SCHEMBL5166818 0.71 MMP1 (0.46) HPGDALDH1A1LMNAKDM4EGAA
SCHEMBL12677941 0.69 HPGD (0.45) HPGDALDH1A1LMNAKDM4EGAA
SCHEMBL2540575 0.69 POLB (0.43) ALDH1A1KDM4EGAAHSD17B10KMT2A
SCHEMBL12086278 0.66 BAZ2B (0.54) HPGDALDH1A1LMNAKDM4EGAA
SCHEMBL13295979 0.65 ALDH1A1 (0.46) HPGDALDH1A1LMNAKDM4EGAA
SCHEMBL2568515 0.64 APOBEC3A (0.42) HPGDALDH1A1LMNAKDM4EGAA
SCHEMBL32690490 0.64 POLB (0.36) ALDH1A1KMT2APOLB
SCHEMBL12424182 0.63 APOBEC3A (0.49) HPGDALDH1A1LMNAKDM4EGAA
SCHEMBL11559372 0.62 POLB (0.43) ALDH1A1LMNAKDM4EGAAHSD17B10

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-1440061-B1 PROCESSES FOR THE MANUFACTURING OF 3-HYDROXY-N,1,6-TRIALKYL-4-OXO-1,4-DIHYDROPYRIDINE-2-CARBOXAMIDE APOTEX INC (CA) 2007-04-11 EP disclosed
EP-1440061-A1 PROCESSES FOR THE MANUFACTURING OF 3-HYDROXY-N,1,6-TRIALKYL-4-OXO-1,4-DIHYDROPYRIDINE-2-CARBOXAMIDE APOTEX INC. (CA) 2004-07-28 EP disclosed
WO-2003037867-A1 PROCESSES FOR THE MANUFACTURING OF 3-HYDROXY-N,1,6-TRIALKYL-4-OXO-1,4-DIHYDROPYRIDINE-2-CARBOXAMIDE APOTEX INC. (CA) 2003-05-08 WO disclosed