SCHEMBL9400423

SCHEMBL9400423

CCN(CC)c1ccc(NC2(NC(C)=O)C(=O)N(c3ccc(C)cc3)N=C2NC(=O)c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.42
RAB9A P51151 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
NPC1 O15118 3/20 0.42
GFER P55789 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
CNR2 P34972 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NOX1 Q9Y5S8 2/20 0.40
LMNA P02545 4/20 0.39
ALDH1A1 P00352 3/20 0.39
CYP2C19 P33261 1/20 0.38
HTT P42858 3/20 0.38
MAPK1 P28482 4/20 0.38
TSHR P16473 3/20 0.38
USP2 O75604 1/20 0.38
TP53 P04637 1/20 0.38
PKM P14618 1/20 0.38
MCL1 Q07820 1/20 0.38

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
SCHEMBL7759853 0.96 MEN1 (0.41) MAPTRAB9ASMN1; SMN2NPC1GFER
SCHEMBL7761024 0.95 MAPT (0.43) MAPTRAB9ASMN1; SMN2NPC1GFER
SCHEMBL9400504 0.93 MEN1 (0.42) MAPTRAB9ASMN1; SMN2NPC1GFER
SCHEMBL9400440 0.91 NPC1 (0.44) MAPTRAB9ASMN1; SMN2NPC1GFER
SCHEMBL9400401 0.91 MAPT (0.44) MAPTRAB9ASMN1; SMN2NPC1GFER
SCHEMBL9400402 0.90 MAPT (0.39) MAPTRAB9ASMN1; SMN2NPC1GFER
SCHEMBL9400379 0.90 MAPT (0.45) MAPTRAB9ASMN1; SMN2NPC1GFER
SCHEMBL7760672 0.90 MEN1 (0.44) MAPTRAB9ASMN1; SMN2NPC1GFER
Diethylamine SCHEMBL9400426 0.88 RAB9A (0.39) MAPTRAB9ASMN1; SMN2NPC1MEN1
SCHEMBL9400452 0.88 NPC1 (0.42) MAPTRAB9ASMN1; SMN2NPC1MEN1

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