SCHEMBL8098960

SCHEMBL8098960

COc1ccc(-c2cn(C3CCN(C(=O)OC(C)(C)C)CC3)c3ncnc(N)c23)cc1

nearest known ligand 0.90

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SRC P12931 12/20 0.90
EGFR P00533 4/20 0.73
ABL1 P00519 3/20 0.73
ABL2 P42684 3/20 0.73
RIPK2 O43353 8/20 0.68

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
SCHEMBL8098911 0.95 SRC (1.00) SRCEGFRABL1ABL2RIPK2
SCHEMBL28667953 0.92 SRC (0.79) SRCEGFRABL1ABL2RIPK2
SCHEMBL8107053 0.91 SRC (0.90) SRCEGFRABL1ABL2RIPK2
SCHEMBL30054291 0.91 SRC (0.78) SRCEGFRABL1ABL2
SCHEMBL6462070 0.91 SRC (0.78) SRCEGFRABL1ABL2
SCHEMBL13020336 0.90 SRC (0.76) SRCEGFRABL1ABL2RIPK2
SCHEMBL8098919 0.90 SRC (0.90) SRCEGFRABL1ABL2RIPK2
SCHEMBL8108104 0.90 SRC (0.91) SRCEGFRABL1ABL2
SCHEMBL7021401 0.88 SRC (0.73) SRCEGFRABL1ABL2RIPK2
SCHEMBL18653507 0.88 SRC (0.73) SRCEGFRABL1ABL2

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
US-6051577-A TYROSINE INHIBITORS; BONE DISORDERS NOVARTIS AG (CH) 2000-04-18 US disclosed