SCHEMBL29448249

SCHEMBL29448249

O=C(Nc1ccccc1)Nc1ccc(NC(=O)Nc2ccccc2)c(NS(=O)(=O)Cc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.51
HPGD P15428 1/20 0.49
ACLY P53396 1/20 0.48
KMT2A Q03164 1/20 0.47
NPC1 O15118 2/20 0.46
MAPT P10636 2/20 0.46
RAB9A P51151 2/20 0.46
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
TP53 P04637 1/20 0.45
EPHX1 P07099 1/20 0.45
TSHR P16473 1/20 0.45
EPHX2 P34913 1/20 0.45
CDK9 P50750 1/20 0.45
CLK4 Q9HAZ1 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
SCHEMBL28935236 1.00 NAMPT (0.51) NAMPTHPGDACLYKMT2ANPC1
SCHEMBL28691820 0.95 NAMPT (0.51) NAMPTHPGDACLYKMT2ANPC1
SCHEMBL29448245 0.95 NAMPT (0.51) NAMPTHPGDACLYKMT2ANPC1
SCHEMBL29448253 0.92 NAMPT (0.54) NAMPTHPGDACLYKMT2ANPC1
SCHEMBL28705140 0.92 NAMPT (0.54) NAMPTHPGDACLYKMT2ANPC1
SCHEMBL29448250 0.85 HPGD (0.51) NAMPTHPGDKMT2ANPC1MAPT
SCHEMBL28696239 0.85 HPGD (0.51) NAMPTHPGDKMT2ANPC1MAPT
SCHEMBL15825710 0.84 IDH1 (0.52) MAPT
SCHEMBL28696250 0.83 HPGD (0.69) NAMPTHPGDKMT2ANPC1MAPT
SCHEMBL29448252 0.83 PGR (0.64) NAMPTHPGDKMT2AMAPTCA12

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
CN-110267939-B Thermosensitive recording material 奥古斯特科勒纸厂欧洲公司 2022-03-15 CN disclosed