SCHEMBL2903376

SCHEMBL2903376

COc1ccc(-c2ccc3ncc(C(=O)O)n3n2)cc1OC

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FYN P06241 19/20 0.71
PIK3CA P42336 1/20 0.67
ATR Q13535 1/20 0.67

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
SCHEMBL3512915 0.83 FYN (1.00) FYNPIK3CAATR
SCHEMBL30521838 0.83 FYN (1.00) FYNPIK3CAATR
SCHEMBL1202851 0.82 FYN (0.62) FYNPIK3CAATR
SCHEMBL14024005 0.81 FYN (0.76) FYNPIK3CAATR
SCHEMBL3512864 0.80 PIK3CA (1.00) FYNPIK3CAATR
SCHEMBL3515271 0.80 FYN (0.74) FYNPIK3CAATR
SCHEMBL18613675 0.79 FYN (1.00) FYN
SCHEMBL16330948 0.78 FYN (1.00) FYNPIK3CAATR
SCHEMBL3514483 0.78 FYN (0.83) FYNPIK3CAATR
SCHEMBL20485736 0.78 FYN (1.00) FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2217601-A1 IMIDAZOPYRIDAZINES FOR USE AS PROTEIN KINASE INHIBITORS Centro Nacional de Investigaciones Oncológicas (CNIO) (ES) 2010-08-18 EP disclosed
WO-2009060197-A1 IMIDAZOPYRIDAZINES FOR USE AS PROTEIN KINASE INHIBITORS CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) 2009-05-14 WO disclosed