SCHEMBL4059253

SCHEMBL4059253

N=C(NCc1ccccc1)Nc1ccc(C(=O)Nc2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.61
PTPN1 P18031 2/20 0.55
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
PPARG P37231 2/20 0.53
MIF P14174 1/20 0.53
HDAC2 Q92769 2/20 0.53
HDAC8 Q9BY41 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
KDM4E B2RXH2 2/20 0.53
POLB P06746 2/20 0.53
SIRT1 Q96EB6 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
HTT P42858 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52

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
SCHEMBL8741867 0.86 MAOB (0.61) PTPN1MEN1KMT2AKDM4EPOLB
SCHEMBL4382965 0.83 NAMPT (0.45) NAMPTMEN1KMT2APPARGMIF
SCHEMBL10644987 0.82 NAMPT (0.58) NAMPTPTPN1MEN1KMT2AMIF
SCHEMBL7168178 0.82 MAOB (0.56) PTPN1MEN1KMT2APOLBNPC1
Hydrochloric Acid SCHEMBL10606782 0.81 F2 (0.57) NAMPTPTPN1MEN1KMT2APPARG
SCHEMBL2839499 0.81 ITGB3 (0.52) NAMPTMEN1KMT2AKDM4EPOLB
SCHEMBL2837835 0.81 NAMPT (0.48) NAMPTMEN1KMT2ANPC1RAB9A
SCHEMBL8614130 0.81 MAOB (0.71) NAMPTMEN1KMT2APOLBRAB9A
SCHEMBL2832025 0.80 NAMPT (0.49) NAMPTMEN1KMT2APPARGNPC1
SCHEMBL2841991 0.80 LMNA (0.49) NAMPTMEN1KMT2A

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
WO-2009061448-A9 METHODS AND COMPOSITIONS FOR THE TREATMENT OF PROTEINURIC DISEASES THE GENERAL HOSPITAL CORPORATION (US) 2009-08-13 WO disclosed