SCHEMBL4048111

SCHEMBL4048111

c1cc2[nH]cnc2cn1.c1cc2cn[nH]c2cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 1/20 0.41
KDM4B O94953 1/20 0.41
KDM5C P41229 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
KDM3A Q9Y4C1 1/20 0.41
MKNK1 Q9BUB5 1/20 0.40
PIM1 P11309 2/20 0.39
PIM3 Q86V86 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
CDK2 P24941 2/20 0.38
HSP90AA1 P07900 1/20 0.38
IDO1 P14902 1/20 0.38
FGFR1 P11362 1/20 0.38
CLK1 P49759 2/20 0.37
QPCT Q16769 1/20 0.37
QPCTL Q9NXS2 1/20 0.37
CCNK O75909 1/20 0.35
CDK12 Q9NYV4 1/20 0.35
DYRK1A Q13627 3/20 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
SCHEMBL1581622 0.83 QPCT (0.35) KDM4AKDM4BKDM5CKDM4CKDM5B
SCHEMBL67119 0.83
SCHEMBL29602491 0.83
Hydrochloric Acid SCHEMBL16162592 0.81 KDM4A (0.53) KDM4AKDM4BKDM5CKDM4CKDM5B
SCHEMBL27982384 0.81 KDM4A (0.53) KDM4AKDM4BKDM5CKDM4CKDM5B
Hydrochloric Acid SCHEMBL2308667 0.81 KDM4A (0.53) KDM4AKDM4BKDM5CKDM4CKDM5B
Bromide SCHEMBL4711523 0.81 KDM4A (0.53) KDM4AKDM4BKDM5CKDM4CKDM5B
SCHEMBL88904 0.81
SCHEMBL29351455 0.81
SCHEMBL28930072 0.79

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-2018383-A1 TRIAZOLOPYRAZINE DERIVATIVES USEFUL AS ANTI-CANCER AGENTS Pfizer Products Inc. (US) 2009-01-28 EP disclosed
WO-2007132308-A1 TRIAZOLOPYRAZINE DERIVATIVES USEFUL AS ANTI-CANCER AGENTS PFIZER PRODUCTS INC. (US) 2007-11-22 WO disclosed