SCHEMBL7019643

SCHEMBL7019643

COc1ccc(-c2cn(C3CCN(OC(=O)O)C3)c3ncnc(N)c23)cc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 9/20 0.69
RIPK2 O43353 10/20 0.66
EGFR P00533 5/20 0.66
ABL1 P00519 4/20 0.66
ABL2 P42684 4/20 0.66
FGFR1 P11362 1/20 0.58
FGFR4 P22455 1/20 0.58

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
SCHEMBL7023764 0.94 SRC (0.71) SRCRIPK2EGFRABL1ABL2
SCHEMBL7027959 0.90 SRC (0.66) SRCRIPK2EGFRABL1ABL2
SCHEMBL7013342 0.90 SRC (0.67) SRCRIPK2EGFRABL1ABL2
SCHEMBL7014659 0.90 ABL1 (0.72) SRCEGFRABL1ABL2FGFR1
SCHEMBL7023086 0.89 SRC (0.76) SRCRIPK2EGFRABL1ABL2
SCHEMBL7020883 0.84 EGFR (0.67) SRCRIPK2EGFRABL1ABL2
SCHEMBL7019158 0.84 ABL1 (0.74) SRCRIPK2EGFRABL1ABL2
SCHEMBL7024626 0.84 SRC (0.70) SRCRIPK2EGFRABL1ABL2
SCHEMBL7023217 0.84 SRC (0.71) SRCRIPK2EGFRABL1ABL2
SCHEMBL7021401 0.83 SRC (0.73) SRCRIPK2EGFRABL1ABL2

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
EP-0888353-B1 N-7-HETEROCYCLYL PYRROLO [2,3-d]PYRIMIDINES AND THEIR USE NOVARTIS AG (CH) 2003-07-09 EP disclosed