SCHEMBL9517034

SCHEMBL9517034

O=C(O)Oc1ccnc(COCc2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 4/20 0.44
TSHR P16473 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NR4A2 P43354 2/20 0.39
SRD5A2 P31213 2/20 0.39
KDM4E B2RXH2 2/20 0.39
KDM5A P29375 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
MAPT P10636 1/20 0.39
NR4A1 P22736 1/20 0.39
NR4A3 Q92570 1/20 0.39
P4HTM Q9NXG6 1/20 0.38
GRM5 P41594 1/20 0.38
HSP90AB1 P08238 1/20 0.38
MAOB P27338 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL9566906 0.82 SPHK2 (0.45) LNPEP
SCHEMBL9566784 0.80 LMNA (0.44) LNPEPMEN1KMT2AKDM4EMAPT
SCHEMBL9517033 0.79 KDM4C (0.52) TSHRMEN1KMT2ANR4A2SRD5A2
SCHEMBL9519559 0.78 P4HTM (0.49) TSHRMEN1KMT2ANR4A2SRD5A2
SCHEMBL9566730 0.78 KDM4E (0.45) LNPEPMEN1KMT2AKDM4EKDM4C
SCHEMBL9566767 0.77 NOS3 (0.38) LNPEPKDM4EKDM5AKDM4CKDM5B
SCHEMBL9367677 0.75 KMT2A (0.49) TSHRMEN1KMT2ASRD5A2P4HTM
SCHEMBL14276269 0.74 TSHR (0.50) TSHRKMT2AKDM4EMAPTGRM5
SCHEMBL9845133 0.72 KMT2A (0.52) TSHRMEN1KMT2AKDM5AKDM4C
SCHEMBL9673277 0.71 TSHR (0.60) TSHRMEN1KMT2AKDM4EMAPT

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
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