SCHEMBL8945285

SCHEMBL8945285

O=C(O)c1ccnc(C(=O)OCc2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 3/20 0.56
KDM4C Q9H3R0 3/20 0.56
KDM5B Q9UGL1 2/20 0.56
ALDH1A1 P00352 2/20 0.56
ALKBH5 Q6P6C2 2/20 0.56
FTO Q9C0B1 2/20 0.56
KDM4E B2RXH2 1/20 0.56
KDM6B O15054 1/20 0.56
TET3 O43151 1/20 0.56
KDM4A O75164 1/20 0.56
BBOX1 O75936 1/20 0.56
MAPT P10636 1/20 0.56
KDM5C P41229 1/20 0.56
ASPH Q12797 1/20 0.56
KDM4D Q6B0I6 1/20 0.56
TET2 Q6N021 1/20 0.56
KDM7A Q6ZMT4 1/20 0.56
KDM8 Q8N371 1/20 0.56
TET1 Q8NFU7 1/20 0.56
EGLN2 Q96KS0 1/20 0.56

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
SCHEMBL8945534 0.93 TDP1 (0.60) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL8945290 0.88 TDP1 (0.58) KDM5AKDM4CKDM5BALDH1A1ALKBH5
SCHEMBL27525131 0.85 PKM (0.59) KDM4CKDM5BALDH1A1KDM4EKDM6B
SCHEMBL24359749 0.82 L3MBTL1 (0.52) ALDH1A1MAPTKMT2ATDP1SLC6A2
SCHEMBL25591895 0.82 SMN1; SMN2 (0.54) ALDH1A1KDM4EEGLN1KMT2ATDP1
SCHEMBL18607390 0.82 PKM (0.52) ALDH1A1MAPTKMT2ATDP1SLC6A2
SCHEMBL24414106 0.82 TDP1 (0.50) ALDH1A1KDM4EMAPTEGLN1KMT2A
SCHEMBL13637123 0.81 TDP1 (0.49) ALDH1A1EGLN1KMT2ATDP1SLC6A2
SCHEMBL1920448 0.80 FTO (0.61) KDM5AKDM4CKDM5BALDH1A1ALKBH5
SCHEMBL24360100 0.80 PKM (0.53) ALDH1A1KDM4EMAPTKMT2ATDP1

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
EP-0409119-B1 N,N'-Bis(alkoxy-alkyl)-pyridine-2,4-dicarboxylic acid amides, process for their preparation as well as their use HOECHST AG (DE) 1994-04-13 EP claimed
US-5519038-A ENZYME INHIBITORS SUITABLE AS FIBROSUPPRESSANTS AND IMMUNOSUPPRESSANTS HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-21 US disclosed
CN-1060655-A 4-or 5-substituted pyridines-2-carboxylic acid, their preparation method and medicinal HOECHST AG (DE) 1992-04-29 CN disclosed