SCHEMBL3830176

SCHEMBL3830176

Cc1cc(C)c2oc(Nc3ccc(-c4nn([C@H]5CC[C@H](CN(C)C(=O)O)CC5)c5ncnc(N)c45)cc3F)nc2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.72
IGF1R P08069 13/20 0.72
ERBB4 Q15303 12/20 0.72
ERBB2 P04626 11/20 0.72
ERBB3 P21860 11/20 0.72
AURKB Q96GD4 6/20 0.62
AURKA O14965 4/20 0.62
KDR P35968 4/20 0.57
ROCK2 O75116 3/20 0.57
ABL1 P00519 3/20 0.57
LCK P06239 3/20 0.57
FYN P06241 3/20 0.57
CSF1R P07333 3/20 0.57
LYN P07948 3/20 0.57
FGFR1 P11362 3/20 0.57
SRC P12931 3/20 0.57
FLT1 P17948 3/20 0.57
EPHA2 P29317 3/20 0.57
FLT4 P35916 3/20 0.57
FLT3 P36888 3/20 0.57

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
SCHEMBL6109795 0.88 EGFR (0.73) EGFRIGF1RERBB4ERBB2ERBB3
SCHEMBL6109791 0.88 EGFR (0.73) EGFRIGF1RERBB4ERBB2ERBB3
SCHEMBL4819751 0.84 EGFR (1.00) EGFRIGF1RERBB4ERBB2ERBB3
SCHEMBL6430800 0.84 EGFR (1.00) EGFRIGF1RERBB4ERBB2ERBB3
SCHEMBL6108400 0.81 EGFR (0.78) EGFRIGF1RERBB4ERBB2ERBB3
SCHEMBL3819964 0.81 EGFR (0.78) EGFRIGF1RERBB4ERBB2ERBB3
SCHEMBL4822802 0.79 EGFR (0.73) EGFRIGF1RERBB4ERBB2ERBB3
SCHEMBL4822825 0.79 EGFR (0.73) EGFRIGF1RERBB4ERBB2ERBB3
SCHEMBL4822096 0.77 EGFR (0.75) EGFRIGF1RERBB4ERBB2ERBB3
SCHEMBL6220226 0.77 EGFR (0.75) EGFRIGF1RERBB4ERBB2ERBB3

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-1730148-A4 AMINOBENZOXAZOLES AS THERAPEUTIC AGENTS ABBOTT LAB (US) 2009-08-19 EP disclosed
EP-1730148-A2 AMINOBENZOXAZOLES AS THERAPEUTIC AGENTS Abbott Laboratories (US) 2006-12-13 EP disclosed
WO-2005074603-A2 AMINOBENZOXAZOLES AS THERAPEUTIC AGENTS ABBOTT LABORATORIES (US) 2005-08-18 WO disclosed