SCHEMBL17744869

SCHEMBL17744869

NNc1cccc(C(=O)O)c1-c1ccccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 1/20 0.50
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
KDM4E B2RXH2 2/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
HSD17B10 Q99714 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.46
MYC P01106 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 1/20 0.46
MMP2 P08253 1/20 0.46
FABP4 P15090 2/20 0.44
FABP3 P05413 1/20 0.44
FABP5 Q01469 1/20 0.44
HNF4A P41235 1/20 0.44
KMT2A Q03164 3/20 0.41

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
SCHEMBL17744779 0.83 MMP2 (0.55) CDC25BNPC1RAB9AKDM4EHSD17B10
SCHEMBL17687655 0.78 ALDH1A1 (0.58) CDC25BNPC1RAB9AKDM4EHSD17B10
SCHEMBL17744822 0.78 MMP2 (0.57) CDC25BNPC1RAB9AKDM4ECASP3
SCHEMBL17744801 0.78 MMP2 (0.49) CDC25BNPC1RAB9AKDM4ECASP3
SCHEMBL143766 0.77 ALDH1A1 (0.59) CDC25BRAB9AKDM4EHSD17B10ALDH1A1
SCHEMBL28316842 0.76 HNF4A (0.61) CDC25BKDM4EHSD17B10ALDH1A1MYC
Hydrochloric Acid SCHEMBL1522753 0.75 FABP4 (0.57) CDC25BRAB9AKDM4EHSD17B10ALDH1A1
Bromide SCHEMBL20984528 0.75 FABP4 (0.57) CDC25BRAB9AKDM4EHSD17B10ALDH1A1
Hydrochloric Acid SCHEMBL27997789 0.75 FABP4 (0.57) CDC25BRAB9AKDM4EHSD17B10ALDH1A1
SCHEMBL10361184 0.74 FABP4 (0.68) CDC25BNPC1RAB9AKDM4ECASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160152785-A1 EPOXY RESIN COMPOSITION, PREPREG, AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL TORAY INDUSTRIES, INC. (JP) 2016-06-02 US disclosed
EP-3020763-A1 EPOXY RESIN COMPOSITION, PREPREG, AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL Toray Industries, Inc. (JP) 2016-05-18 EP disclosed