SCHEMBL7844216

SCHEMBL7844216

COc1cc(OC)cc(-c2cn(-c3ccccc3)c3ncnc(N)c23)c1

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRC P12931 20/20 0.83
EGFR P00533 11/20 0.83
ABL1 P00519 9/20 0.83
ABL2 P42684 9/20 0.83
CDK1 P06493 6/20 0.83
KDR P35968 5/20 0.80

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
SCHEMBL7848082 0.93 SRC (0.80) SRCEGFRABL1ABL2CDK1
SCHEMBL7834901 0.91 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL7848142 0.89 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL7835001 0.84 SRC (0.73) SRCEGFRABL1ABL2CDK1
SCHEMBL31061695 0.83 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL5936176 0.83 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL7835073 0.81 SRC (0.69) SRCEGFRABL1ABL2CDK1
SCHEMBL15934520 0.81 SRC (0.80) SRCEGFRABL1ABL2CDK1
SCHEMBL5741114 0.80 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL20351594 0.80 SRC (0.86) SRCEGFRABL1ABL2CDK1

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-0783505-B1 PYRROLO[2,3-d]PYRIMIDINES AND THEIR USE NOVARTIS AG (CH) 2001-03-07 EP disclosed
EP-0783505-A1 PYRROLO[2,3-d]PYRIMIDINES AND THEIR USE Novartis AG (CH) 1997-07-16 EP disclosed
WO-1996010028-A1 PYRROLO[2,3-d]PYRIMIDINES AND THEIR USE NOVARTIS AG (CH) 1996-04-04 WO disclosed