SCHEMBL16006920

SCHEMBL16006920

CNC(=O)CNCc1cc(/C=N\C2CC2)ccn1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 10/20 0.34
▸ KDM5C P41229 7/20 0.34
▸ KDM5A P29375 5/20 0.34
▸ KDM4A O75164 3/20 0.34
▸ KDM6B O15054 1/20 0.34
▸ KDM2B Q8NHM5 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ KDM4C Q9H3R0 2/20 0.33
▸ KDM4B O94953 2/20 0.33
▸ KDM5D Q9BY66 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ GSK3B P49841 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL17984985 0.87 KDM5B (0.38) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL18860202 0.86 KDM5B (0.36) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16305524 0.86 KDM5B (0.36) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL18831148 0.86 KDM5B (0.36) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16305495 0.85 KDM5B (0.43) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16303320 0.83 KDM4E (0.40) KDM4E
SCHEMBL15995309 0.83 KDM4E (0.40) KDM4E
SCHEMBL16293500 0.81 KDM5B (0.36) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL16006940 0.81 KDM5B (0.36) KDM5BKDM5CKDM5AKDM4AKDM6B
SCHEMBL15995289 0.80 MEN1 (0.41) KDM4ESMN1; SMN2HPGDALDH1A1MEN1

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
WO-2014131777-A1 INHIBITORS OF HISTONE DEMETHYLASES EPITHERAPEUTICS APS (DK) 2014-09-04 — — WO disclosed
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