SCHEMBL9400402

SCHEMBL9400402

CCN(CC)c1ccc(NC2(NC(C)=O)C(=O)N(c3ccccc3)N=C2NC(=O)c2cc(C)c(C)c(C)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
NOX1 Q9Y5S8 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
ALDH1A1 P00352 6/20 0.38
MAPK1 P28482 4/20 0.38
GFER P55789 3/20 0.38
NPSR1 Q6W5P4 3/20 0.38
HCRTR1 O43613 1/20 0.38
LMNA P02545 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 2/20 0.38
HTT P42858 1/20 0.38
CYP2C19 P33261 1/20 0.37
TP53 P04637 2/20 0.37
MCL1 Q07820 2/20 0.37
USP2 O75604 1/20 0.37
PKM P14618 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
SCHEMBL7761024 0.92 MAPT (0.43) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL7759853 0.91 MEN1 (0.41) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL9400480 0.90 MEN1 (0.41) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL9400379 0.90 MAPT (0.45) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL9400423 0.90 MAPT (0.42) MAPTMEN1KMT2ANOX1NPC1
Diethylamine SCHEMBL9400407 0.89 NTRK1 (0.36) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL9400382 0.88 MEN1 (0.45) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL9400408 0.88 MAPT (0.40) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL7760672 0.88 MEN1 (0.44) MAPTMEN1KMT2ANOX1NPC1
SCHEMBL9400401 0.87 MAPT (0.44) MAPTMEN1KMT2ANOX1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5372917-A Excellent color forming property, storage stability and recorded image preservability; pyrazolone derivatives KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1994-12-13 US disclosed