SCHEMBL24556549

SCHEMBL24556549

Cc1c[nH]c(=O)c2ccncc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 5/20 0.47
KDM4A O75164 1/20 0.47
KDM4B O94953 1/20 0.47
KDM5C P41229 1/20 0.47
KDM5B Q9UGL1 1/20 0.47
KDM3A Q9Y4C1 1/20 0.47
PARP1 P09874 5/20 0.42
PIM1 P11309 2/20 0.41
PIM3 Q86V86 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
DYRK1A Q13627 4/20 0.38
CSNK2A1 P68400 3/20 0.38
GSK3B P49841 2/20 0.38
CDK2 P24941 2/20 0.38
ROCK1 Q13464 2/20 0.38
AURKA O14965 1/20 0.38
DAPK3 O43293 1/20 0.38
JAK2 O60674 1/20 0.38
ROCK2 O75116 1/20 0.38
CHEK2 O96017 1/20 0.38

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
SCHEMBL30596070 0.78 HASPIN (0.49) KDM4CKDM4AKDM4BKDM5CKDM5B
SCHEMBL17163962 0.78 KDM4C (0.47) KDM4CKDM4AKDM4BKDM5CKDM5B
SCHEMBL22305924 0.78 KDM5C (0.47) KDM4CKDM4AKDM4BKDM5CKDM5B
SCHEMBL16139620 0.78 KDM5C (0.47) KDM4CKDM4AKDM4BKDM5CKDM5B
SCHEMBL245345 0.78 KDM4C (0.47) KDM4CKDM4AKDM4BKDM5CKDM5B
SCHEMBL17164016 0.78 GSK3B (0.48) KDM4CKDM4AKDM4BKDM5CKDM5B
SCHEMBL245965 0.77 KDM4A (0.44) KDM4CKDM4AKDM4BKDM5CKDM5B
SCHEMBL25003259 0.77 KDM4C (0.44) KDM4CKDM4AKDM4BKDM5CKDM5B
Bromide SCHEMBL14969315 0.76 KDM5C (0.46) KDM4CKDM4AKDM4BKDM5CKDM5B
SCHEMBL2619228 0.75 DYRK1A (0.56) PIM1PIM3PIM2DYRK1AGSK3B

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-3265453-B1 NEW PYRIDINONES AND ISOQUINOLINONES AS INHIBITORS OF THE BROMODOMAIN BRD9 BOEHRINGER INGELHEIM INT (DE) 2022-06-29 EP disclosed