SCHEMBL7843353

SCHEMBL7843353

COc1cccc(-c2cn(-c3cccc(OCCCO)c3)c3ncnc(N)c23)c1

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SRC P12931 20/20 0.78
ABL1 P00519 6/20 0.78
EGFR P00533 6/20 0.78
ABL2 P42684 6/20 0.78
CDK1 P06493 2/20 0.78
KDR P35968 1/20 0.60

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
SCHEMBL7847554 0.96 SRC (0.80) SRCABL1EGFRABL2CDK1
SCHEMBL7847655 0.93 SRC (0.82) SRCABL1EGFRABL2CDK1
SCHEMBL7847017 0.91 SRC (0.77) SRCABL1EGFRABL2CDK1
SCHEMBL7842183 0.91 SRC (0.70) SRCABL1EGFRABL2CDK1
SCHEMBL7844821 0.90 SRC (0.78) SRCABL1EGFRABL2CDK1
SCHEMBL7845672 0.90 SRC (0.89) SRCABL1EGFRABL2CDK1
SCHEMBL7845797 0.89 SRC (0.77) SRCABL1EGFRABL2CDK1
SCHEMBL7843527 0.89 SRC (0.85) SRCABL1EGFRABL2CDK1
SCHEMBL7842849 0.89 SRC (0.73) SRCABL1EGFRABL2CDK1
SCHEMBL7834902 0.88 SRC (0.63) SRCABL1EGFRABL2CDK1

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 4 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
US-5869485-A Pyrrolo 2,3-d!pyrimidines and their use NOVARTIS FINANCE CORP. (US) 1999-02-09 US 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