SCHEMBL11403167

SCHEMBL11403167

O=C(O)CNCc1cc(O)ccn1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 14/20 0.43
KDM5C P41229 9/20 0.43
KDM4A O75164 4/20 0.43
KDM4B O94953 2/20 0.43
KDM5A P29375 6/20 0.43
KDM6B O15054 1/20 0.43
KDM2B Q8NHM5 1/20 0.43
KDM4C Q9H3R0 2/20 0.40
KDM5D Q9BY66 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.37
EGLN2 Q96KS0 1/20 0.36
FTO Q9C0B1 1/20 0.36
NR4A2 P43354 1/20 0.35
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL18160696 0.82 KDM5B (0.45) KDM5BKDM5CKDM4AKDM4BKDM5A
SCHEMBL29129147 0.80 KDM5B (0.60) KDM5BKDM5CKDM4AKDM4BKDM5A
SCHEMBL24510177 0.78 KDM5B (0.40) KDM5BKDM5CKDM4AKDM4BKDM5A
SCHEMBL472123 0.76 SMN1; SMN2 (0.61) SMN1; SMN2KDM4EHTT
SCHEMBL14998815 0.71 MAOB (0.61) KDM4EHTT
SCHEMBL2314292 0.71 EGLN1 (0.48) KDM5BKDM5CKDM4AKDM4BFTO
SCHEMBL7673352 0.70
SCHEMBL23120658 0.70 KDM5B (0.52) KDM5BKDM5CKDM4AKDM4BKDM5A
SCHEMBL18160821 0.69 NPSR1 (0.53) SMN1; SMN2NR4A2
SCHEMBL12276187 0.69 SLC2A4 (0.56) KDM4E

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
US-4216226-A GLYCINE DERIVATIVE MEIJI SEIKA KAISHA, LTD. (JP) 1980-08-05 US disclosed