SCHEMBL8819665

SCHEMBL8819665

Nc1ncnc2c(-c3ccccc3)cn(-c3cccc(O)c3)c12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SRC P12931 13/20 0.53
EGFR P00533 8/20 0.53
ABL1 P00519 7/20 0.53
ABL2 P42684 7/20 0.53
CDK1 P06493 5/20 0.53
KDR P35968 5/20 0.51
CSK P41240 1/20 0.47
LIMK1 P53667 1/20 0.42
PIK3CG P48736 2/20 0.41
OPRD1 P41143 2/20 0.41
PIK3CD O00329 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PRKDC P78527 1/20 0.41
MAP4K4 O95819 2/20 0.41
OPRM1 P35372 1/20 0.41

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
SCHEMBL8820858 0.86 SRC (0.54) SRCEGFRABL1ABL2CDK1
SCHEMBL8820527 0.85 PI4KA (0.53) SRCEGFRABL1ABL2CDK1
SCHEMBL8820776 0.84 SRC (0.48) SRCEGFRABL1ABL2CDK1
SCHEMBL8819623 0.83 SRC (0.61) SRCEGFRABL1ABL2CDK1
SCHEMBL7843715 0.81 SRC (0.78) SRCEGFRABL1ABL2CDK1
SCHEMBL8819680 0.80 SRC (0.36) SRCEGFRABL1ABL2CDK1
SCHEMBL8819661 0.79 SRC (0.38) SRCEGFRABL1ABL2CDK1
SCHEMBL8819667 0.78 SRC (0.35) SRCEGFRABL1ABL2CDK1
SCHEMBL8820773 0.78 PIK3CD (0.41) SRCEGFRABL1ABL2CDK1
SCHEMBL8819650 0.77 SRC (0.55) SRC

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
WO-1997049706-A1 SUBSTITUTED 7-AMINO-PYRROLO[3,2-d]PYRIMIDINES AND THE USE THEREOF NOVARTIS AG (CH) 1997-12-31 WO claimed