SCHEMBL7258663

SCHEMBL7258663

CNc1ccc2ccc(C(=O)O)c(C(=O)NN)c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.38
PLG P00747 3/20 0.36
KLK1 P06870 3/20 0.36
KDM4E B2RXH2 5/20 0.36
MAPT P10636 5/20 0.36
TDP1 Q9NUW8 3/20 0.36
POLB P06746 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
WDR5 P61964 1/20 0.35
PRMT1 Q99873 1/20 0.35
ALDH1A1 P00352 4/20 0.35
GAA P10253 3/20 0.35
LDHA P00338 1/20 0.34
GFER P55789 1/20 0.34
KLK6 Q92876 2/20 0.34
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
F3 P13726 1/20 0.33
PRSS3 P35030 1/20 0.33

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
SCHEMBL9645930 0.81 MAPT (0.48) MYCKDM4EMAPTTDP1POLB
SCHEMBL7523007 0.81 ALDH1A1 (0.51) KDM4EMAPTTDP1WDR5ALDH1A1
SCHEMBL29572861 0.79 SLC16A3 (0.44) MYCPLGKDM4EMAPTWDR5
SCHEMBL189571 0.79 SLC16A3 (0.44) MYCPLGKDM4EMAPTWDR5
SCHEMBL3966511 0.79 MYC (0.37) MYCKDM4EMAPTTDP1WDR5
SCHEMBL5480836 0.77 WDR5 (0.56) PLGKLK1KDM4EMAPTTDP1
SCHEMBL998376 0.74 CYP1A2 (0.46) MYCKDM4EMAPTTDP1POLB
SCHEMBL712805 0.74 WDR5 (0.51) PLGKLK1KDM4EMAPTTDP1
SCHEMBL2678880 0.74 MYC (0.49) MYCKDM4EMAPTTDP1NPC1
SCHEMBL10585188 0.71 DHFR (0.36) MYCKDM4EMAPTTDP1WDR5

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-6641638-B1 Hydrogen peroxide converts the nitrogen oxides to nitric acid, assuring that there is little nitrous acid remaining; acids are further reacted with potassium oxide to form potassium nitrate THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS & SPACE ADMINISTRATION 2003-11-04 US disclosed
US-6039783-A Process and equipment for nitrogen oxide waste conversion to fertilizer THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) 2000-03-21 US disclosed