SCHEMBL1505808

SCHEMBL1505808

O=C(O)c1ccnc(-c2nccc(C(=O)O)n2)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.57
KDM5A P29375 2/20 0.57
KDM3A Q9Y4C1 2/20 0.57
JMJD1C Q15652 1/20 0.57
ALDH1A1 P00352 4/20 0.54
KDM6B O15054 1/20 0.54
TET3 O43151 1/20 0.54
KDM4A O75164 1/20 0.54
BBOX1 O75936 1/20 0.54
MAPT P10636 1/20 0.54
KDM5C P41229 1/20 0.54
ASPH Q12797 1/20 0.54
KDM4D Q6B0I6 1/20 0.54
TET2 Q6N021 1/20 0.54
ALKBH5 Q6P6C2 1/20 0.54
KDM7A Q6ZMT4 1/20 0.54
KDM8 Q8N371 1/20 0.54
TET1 Q8NFU7 1/20 0.54
EGLN2 Q96KS0 1/20 0.54
FTO Q9C0B1 1/20 0.54

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
SCHEMBL696116 0.86 XDH (0.50) KDM4EKDM5AKDM3AJMJD1CALDH1A1
SCHEMBL23869649 0.85 KDM4E (0.45) KDM4EKDM5AKDM3AJMJD1CALDH1A1
Hydrochloric Acid SCHEMBL7968706 0.84 XDH (0.49) KDM4EKDM5AKDM3AJMJD1CALDH1A1
SCHEMBL17431579 0.82 KDM4E (0.52) KDM4EKDM5AKDM3AJMJD1CALDH1A1
SCHEMBL28988552 0.81 XDH (0.56) KDM4EKDM5AKDM3AJMJD1CMAPT
SCHEMBL31301691 0.81 MAP4K4 (0.56) KDM4EKDM5AKDM3AJMJD1CMAPT
SCHEMBL34461785 0.81 XDH (0.56) KDM4EKDM5AKDM3AJMJD1CALDH1A1
SCHEMBL27831948 0.80 KDM4E (0.44) KDM4EKDM5AKDM3AJMJD1CALDH1A1
SCHEMBL320207 0.80 KDM4E (0.47) KDM4EKDM5AKDM3AJMJD1CALDH1A1
SCHEMBL31229372 0.80 CYP4F2 (0.50) KDM4EKDM5AKDM3AJMJD1CALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2296171-A2 Use of metal-organic frame materials for producing microelectronic components BASF SE (DE) 2011-03-16 EP disclosed