SCHEMBL6271016

SCHEMBL6271016

Cc1cc(C)c2oc(Nc3ccc(-c4nn(C5CCN(C(=O)OC(C)(C)C)C5)c5ccnc(N)c45)cc3)nc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.51
IGF1R P08069 10/20 0.51
ERBB4 Q15303 9/20 0.51
KDR P35968 5/20 0.51
SRC P12931 4/20 0.51
AURKB Q96GD4 3/20 0.51
ABL1 P00519 3/20 0.51
PLK4 O00444 2/20 0.51
MAPK13 O15264 2/20 0.51
PDPK1 O15530 2/20 0.51
DAPK3 O43293 2/20 0.51
JAK2 O60674 2/20 0.51
ROCK2 O75116 2/20 0.51
PAK4 O96013 2/20 0.51
NTRK1 P04629 2/20 0.51
INSR P06213 2/20 0.51
LCK P06239 2/20 0.51
FYN P06241 2/20 0.51
CDK1 P06493 2/20 0.51
CSF1R P07333 2/20 0.51

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
SCHEMBL6276338 0.95 EGFR (0.52) EGFRIGF1RERBB4KDRSRC
SCHEMBL4818524 0.90 EGFR (0.64) EGFRIGF1RERBB4KDRSRC
SCHEMBL3847596 0.87 EGFR (0.54) EGFRIGF1RERBB4KDRSRC
SCHEMBL4827091 0.86 EGFR (0.62) EGFRIGF1RERBB4KDRSRC
SCHEMBL6431893 0.86 EGFR (0.67) EGFRIGF1RERBB4KDRSRC
SCHEMBL4823150 0.85 EGFR (0.65) EGFRIGF1RERBB4KDRSRC
SCHEMBL5813839 0.84 EGFR (0.60) EGFRIGF1RERBB4KDRSRC
SCHEMBL6249516 0.83 EGFR (0.54) EGFRIGF1RERBB4KDRSRC
SCHEMBL6262161 0.83 EGFR (0.58) EGFRIGF1RERBB4KDRSRC
SCHEMBL6249667 0.82 EGFR (0.56) EGFRIGF1RERBB4KDRSRC

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1379528-A4 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GMBH (DE) 2005-12-07 EP disclosed
EP-1379528-A1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GmbH (DE) 2004-01-14 EP disclosed
WO-2002076986-A1 PYRAZOLOPYRIMIDINES AS THERAPEUTIC AGENTS ABBOTT GMBH & CO. KG (DE) 2002-10-03 WO disclosed