SCHEMBL6919590

SCHEMBL6919590

N#Cc1ccc(NC(=O)c2cc3cccc(NC(=O)c4ccc(Cl)nc4)c3[nH]2)c(-c2noc(=O)[nH]2)c1.NC(=O)c1onc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDR P35968 1/20 0.34
F10 P00742 1/20 0.33
MDM4 O15151 1/20 0.33
TP53 P04637 1/20 0.33
MDM2 Q00987 1/20 0.33
KDM4E B2RXH2 2/20 0.32
HDAC1 Q13547 2/20 0.32
PDE10A Q9Y233 1/20 0.32
MAPK1 P28482 1/20 0.32
STK33 Q9BYT3 1/20 0.32
PTGDR2 Q9Y5Y4 2/20 0.32
PLA2G7 Q13093 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
AURKA O14965 1/20 0.30

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
SCHEMBL6714034 0.90 KMT2A (0.47) MEN1KMT2AL3MBTL1KDRF10
SCHEMBL6708854 0.82 KMT2A (0.42) MEN1KMT2AHDAC1PDE10ASTK33
SCHEMBL6709991 0.81 KDR (0.44) MEN1KMT2AL3MBTL1KDRF10
SCHEMBL6711934 0.80 PRSS12 (0.39) MEN1KMT2APLA2G7NPC1RAB9A
SCHEMBL6710055 0.80 IRAK4 (0.41) MEN1KMT2AHDAC1PDE10APLA2G7
SCHEMBL6713714 0.80 KDR (0.43) MEN1KMT2AL3MBTL1KDRMDM4
SCHEMBL6711406 0.79 GRIK1 (0.38) MEN1KMT2AKDM4EHDAC1PLA2G7
SCHEMBL6713406 0.79 NPC1 (0.41) PLA2G7NPC1RAB9ASMN1; SMN2
SCHEMBL6710182 0.78 ALDH1A1 (0.40) MEN1KMT2AKDM4EHDAC1PLA2G7
SCHEMBL6711762 0.78 MAP3K5 (0.41) KMT2ATP53MAPK1PLA2G7NPC1

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-2004018461-A2 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 WO disclosed