SCHEMBL13403443

SCHEMBL13403443

CN(C)c1cc(=O)n2cccc(O)c2n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.64
ALDH1A1 P00352 3/20 0.64
GAA P10253 3/20 0.64
LMNA P02545 1/20 0.64
GLA P06280 1/20 0.64
MPI P34949 1/20 0.64
PRKDC P78527 1/20 0.42
CHEK1 O14757 1/20 0.40
AURKA O14965 1/20 0.40
DAPK3 O43293 1/20 0.40
JAK2 O60674 1/20 0.40
PRKD3 O94806 1/20 0.40
MAP4K4 O95819 1/20 0.40
PAK4 O96013 1/20 0.40
ABL1 P00519 1/20 0.40
NTRK1 P04629 1/20 0.40
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
CSF1R P07333 1/20 0.40
RET P07949 1/20 0.40

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
SCHEMBL7011577 0.80 KDM4E (0.97) KDM4EALDH1A1GAALMNAGLA
SCHEMBL13050024 0.79 KDM4E (0.69) KDM4EALDH1A1GAALMNAGLA
SCHEMBL17808863 0.78 KDM4E (0.59) KDM4EALDH1A1GAALMNAGLA
SCHEMBL3715566 0.76 KDM4E (0.65) KDM4EALDH1A1GAALMNAGLA
SCHEMBL2906540 0.76 ALDH1A1 (0.64) KDM4EALDH1A1GAALMNAGLA
SCHEMBL2905445 0.76 KDM4E (0.64) KDM4EALDH1A1GAALMNAGLA
SCHEMBL2899752 0.76 ALDH1A1 (0.64) KDM4EALDH1A1GAALMNAGLA
SCHEMBL13403441 0.74 LMNA (0.37) KDM4EALDH1A1GAALMNAGLA
SCHEMBL17802261 0.74 ALDH1A1 (0.61) KDM4EALDH1A1GAALMNAGLA
SCHEMBL2906516 0.74 KDM4E (0.61) KDM4EALDH1A1GAALMNAGLA

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-7696203-B2 DNA-PK inhibitors KUDOS PHARMACEUTICALS LIMITED (GB) 2010-04-13 US disclosed