SCHEMBL13199237

SCHEMBL13199237

O=C(Cc1cccc(O)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
MAPT P10636 6/20 0.60
TP53 P04637 1/20 0.60
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
KDM4E B2RXH2 1/20 0.54
POLB P06746 2/20 0.53
THRB P10828 1/20 0.53
MCL1 Q07820 1/20 0.53
CTDSP1 Q9GZU7 1/20 0.53
GAA P10253 1/20 0.52
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
L3MBTL1 Q9Y468 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49

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
SCHEMBL13199173 0.90 ALDH1A1 (0.54) ALDH1A1MAPTTP53MEN1KMT2A
SCHEMBL13199158 0.89 ALDH1A1 (0.58) ALDH1A1MAPTTP53MEN1KMT2A
SCHEMBL13199110 0.85 KDM4E (0.55) ALDH1A1MEN1KMT2AKDM4EPOLB
SCHEMBL2961298 0.84 ALDH1A1 (0.48) ALDH1A1MAPTTP53MEN1KMT2A
SCHEMBL14097977 0.83 ALDH1A1 (0.47) ALDH1A1MAPTTP53MEN1KMT2A
SCHEMBL13199231 0.82 TDP1 (0.62) ALDH1A1MEN1KMT2AKDM4EPOLB
SCHEMBL13199160 0.81 TDP1 (0.55) ALDH1A1MEN1KMT2AKDM4EPOLB
SCHEMBL13199232 0.81 NLRP3 (0.55) ALDH1A1MEN1KMT2AKDM4EPOLB
SCHEMBL13199178 0.81 NPC1 (0.55) ALDH1A1TP53MEN1KMT2AKDM4E
SCHEMBL13199195 0.81 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767716-B2 Acyl hydrazines as kinase inhibitors, in particular for SGK MERCK PATENT GMBH (DE) 2010-08-03 US disclosed
EP-1866280-B1 ACYL HYDRAZIDES AS KINASE INHIBITORS, IN PARTICULAR FOR SGK MERCK PATENT GMBH (DE) 2008-08-13 EP disclosed
US-20080167380-A1 Acyl Hydrazines as Kinase Inhibitors, in Particular for Sgk MERCK PATENT GMBH (DE) 2008-07-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080167380-A1 Acyl Hydrazines as Kinase Inhibitors, in Particular for Sgk SGK1, AGK, SGK2 ALDH1A1 1664/4885MAPT 4448/4885TP53 4760/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.