SCHEMBL8209236

SCHEMBL8209236

CC(=O)CC(=O)Nc1cccc(P(=O)(O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
KDM4E B2RXH2 2/20 0.60
ALDH1A1 P00352 1/20 0.60
CYP1A2 P05177 1/20 0.60
CYP2C19 P33261 1/20 0.60
HIF1A Q16665 1/20 0.60
MAPT P10636 2/20 0.55
POLB P06746 3/20 0.47
NR4A1 P22736 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 3/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA4 P22748 1/20 0.45
CA7 P43166 1/20 0.45
TSHR P16473 1/20 0.44
GAA P10253 2/20 0.44
ALOX15 P16050 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL19262173 0.86 RAB9A (0.61) MEN1KMT2AALDH1A1CYP1A2CYP2C19
SCHEMBL28618160 0.83 MAPT (0.57) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8752439 0.83 MEN1 (0.66) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL8920988 0.81 HDAC1 (0.56) MEN1KMT2AKDM4ERAB9ASMN1; SMN2
SCHEMBL8921000 0.81 HDAC1 (0.56) MEN1KMT2AKDM4ERAB9ASMN1; SMN2
SCHEMBL7129266 0.80 CA1 (0.41) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL11761862 0.78 RAB9A (0.74) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL12574796 0.78 TDP1 (0.62) KMT2AKDM4EALDH1A1CYP1A2POLB
SCHEMBL11757044 0.77 RAB9A (0.77) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL13986874 0.77 MEN1 (0.58) MEN1KMT2AKDM4EALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0988343-A1 METHOD FOR DYING ALUMINUM OXIDE LAYERS Clariant Finance (BVI) Limited (VG) 2000-03-29 EP disclosed
EP-0986615-A1 1:2 CHROMIUM COMPLEX DYES, THE PRODUCTION AND USE THEREOF Clariant Finance (BVI) Limited (VG) 2000-03-22 EP disclosed
WO-1998058025-A1 METHOD FOR DYING ALUMINUM OXIDE LAYERS CLARIANT FINANCE (BVI) LIMITED (VG) 1998-12-23 WO disclosed
WO-1998054264-A1 1:2 CHROMIUM COMPLEX DYES, THE PRODUCTION AND USE THEREOF CLARIANT FINANCE (BVI) LIMITED (VG) 1998-12-03 WO disclosed