SCHEMBL7835361

SCHEMBL7835361

Nc1ncnc2c1c(-c1ccccc1)cn2-c1ccc(CO)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 19/20 1.00
EGFR P00533 15/20 1.00
ABL1 P00519 11/20 1.00
ABL2 P42684 11/20 1.00
CDK1 P06493 7/20 1.00
KDR P35968 6/20 1.00
CSK P41240 2/20 0.74

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
SCHEMBL7847551 0.95 SRC (0.91) SRCEGFRABL1ABL2CDK1
SCHEMBL7847078 0.90 SRC (0.82) SRCEGFRABL1ABL2CDK1
SCHEMBL7847946 0.89 SRC (0.80) SRCEGFRABL1ABL2CDK1
SCHEMBL7845704 0.88 SRC (0.84) SRCEGFRABL1ABL2CDK1
SCHEMBL5936176 0.88 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL31061695 0.88 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL7843386 0.87 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL7846812 0.85 SRC (0.74) SRCEGFRABL1ABL2CDK1
SCHEMBL7841930 0.85 SRC (1.00) SRCEGFRABL1ABL2CDK1
SCHEMBL11922280 0.85 SRC (0.78) 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