SCHEMBL9517033

SCHEMBL9517033

O=C(O)c1ccnc(COCc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 10/20 0.52
KDM5A P29375 9/20 0.52
KDM5B Q9UGL1 9/20 0.52
NR4A2 P43354 2/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NR4A1 P22736 1/20 0.47
NR4A3 Q92570 1/20 0.47
KDM2B Q8NHM5 2/20 0.47
KDM5C P41229 5/20 0.47
KDM4A O75164 4/20 0.47
KDM4B O94953 1/20 0.47
KDM4E B2RXH2 3/20 0.46
KDM6B O15054 2/20 0.46
KDM2A Q9Y2K7 2/20 0.46
KDM3A Q9Y4C1 2/20 0.46
EGLN1 Q9GZT9 2/20 0.46
TSHR P16473 1/20 0.46
CYSLTR1 Q9Y271 1/20 0.46
TET3 O43151 1/20 0.45

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
SCHEMBL27925527 0.81 KDM4C (0.62) KDM4CKDM5AKDM5BKDM2BKDM5C
SCHEMBL9519602 0.80 ALKBH2 (0.53) ALKBH5FTO
SCHEMBL27542831 0.80 KDM4C (0.63) KDM4CKDM5AKDM5BKDM2BKDM5C
SCHEMBL9517034 0.79 LNPEP (0.44) KDM4CKDM5AKDM5BNR4A2MEN1
SCHEMBL27683139 0.79 RXRA (0.52) NR4A2NR4A1NR4A3EGLN1CYSLTR1
SCHEMBL837794 0.78 NR4A2 (0.58) KDM4CKDM5AKDM5BNR4A2MEN1
Hydrochloric Acid SCHEMBL30523486 0.78 KDM4C (0.61) KDM4CKDM5AKDM5BKDM2BKDM5C
SCHEMBL5567317 0.78 ALDH1A1 (0.55) KDM4CKDM5AKDM5BNR4A2KDM2B
SCHEMBL5566899 0.78 KDM4C (0.47) KDM4CKDM5AKDM5BKDM2BKDM5C
SCHEMBL17820831 0.78 KDM4C (0.53) KDM4CKDM5AKDM5BKDM2BKDM5C

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
CN-1079466-A 4-or 5-(sulphur) acylimino-and (inferior sulphur) amidopyridine and pyridine-N-oxide thereof HOECHST AG (DE) 1993-12-15 CN disclosed
EP-0567997-A1 4- or 5-(sulf)imido- and (sulfon)amidopyridines and their pyridine-N-oxides, process for their preparation and their use as pharmaceutical HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 EP disclosed
EP-0533130-A1 2-Hydroxymethylpyridines, the corresponding pyridine-N-oxides and derivatives thereof, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-24 EP disclosed