SCHEMBL7843386

SCHEMBL7843386

Nc1ncnc2c1c(-c1ccccc1)cn2-c1cccc(CO)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 18/20 1.00
EGFR P00533 14/20 1.00
ABL1 P00519 10/20 1.00
ABL2 P42684 10/20 1.00
CDK1 P06493 7/20 1.00
KDR P35968 6/20 0.77
CSK P41240 2/20 0.76

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
SCHEMBL7847337 0.92 SRC (0.85) SRCEGFRABL1ABL2CDK1
SCHEMBL1901072 0.91 SRC (0.82) SRCEGFRABL1ABL2CDK1
SCHEMBL1895898 0.90 SRC (0.82) SRCEGFRABL1ABL2CDK1
SCHEMBL7835166 0.90 SRC (0.81) SRCEGFRABL1ABL2CDK1
SCHEMBL7845870 0.88 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL7835361 0.87 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL7843715 0.87 SRC (0.78) SRCEGFRABL1ABL2CDK1
SCHEMBL7847551 0.87 SRC (0.91) SRCEGFRABL1ABL2CDK1
SCHEMBL7845816 0.86 SRC (0.76) SRCEGFRABL1ABL2CDK1
SCHEMBL7844673 0.86 SRC (0.76) 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