SCHEMBL8490286

SCHEMBL8490286

NC(=O)c1nc(Nc2ccc(C(=O)c3ncc[nH]3)c(Cl)c2)c2c[c]ncc2n1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
GRM4 Q14833 3/20 0.35
BRAF P15056 2/20 0.33
HDAC1 Q13547 1/20 0.33
AURKA O14965 1/20 0.32
RPS6KB1 P23443 1/20 0.32
CSF1R P07333 3/20 0.32
EGFR P00533 3/20 0.31
PIM1 P11309 2/20 0.31
PIM2 Q9P1W9 2/20 0.31
KDR P35968 1/20 0.31
F2RL1 P55085 1/20 0.31
SYK P43405 3/20 0.31
CSNK2A2 P19784 2/20 0.31
CSNK2B P67870 2/20 0.31
CSNK2A1 P68400 2/20 0.31

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
SCHEMBL2998232 0.80 EGFR (0.46) KMT2AAURKARPS6KB1CSF1REGFR
SCHEMBL8082010 0.77 SYK (0.46) EGFRKDRSYKCSNK2A1
SCHEMBL8150757 0.75 PDE7A (0.38) GRM4AURKARPS6KB1EGFRPIM1
SCHEMBL8487402 0.73 EGFR (0.30) EGFRPIM1PIM2KDRCSNK2A2
SCHEMBL8490290 0.72 GRM1 (0.58) KMT2AEGFR
SCHEMBL2986229 0.72 AURKA (0.45) AURKARPS6KB1EGFRKDRSYK
SCHEMBL8307733 0.68 KMT2A (0.64) KMT2ABRAFHDAC1F2RL1
SCHEMBL8096003 0.67 KDM4C (0.38) KMT2AHDAC1EGFRSYK
SCHEMBL2989950 0.67 EGFR (0.47) AURKARPS6KB1CSF1REGFRKDR
SCHEMBL8093494 0.66 XDH (0.33) KMT2ACSF1RKDR

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-1999006378-A1 IRREVERSIBLE INHIBITORS OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 1999-02-11 WO claimed