SCHEMBL7845830

SCHEMBL7845830

Cc1cc(-c2cn(-c3cccc(OCCn4ccnc4)c3)c3ncnc(N)c23)cc(C)c1OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SRC P12931 14/20 0.64
EGFR P00533 8/20 0.49
ABL1 P00519 6/20 0.49
ABL2 P42684 6/20 0.49
CDK1 P06493 5/20 0.49
IGF1R P08069 4/20 0.46
KDR P35968 4/20 0.45
CSK P41240 1/20 0.45
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL7844157 0.91 SRC (0.64) SRCEGFRABL1ABL2CDK1
SCHEMBL7834123 0.90 SRC (0.73) SRCEGFRABL1ABL2CDK1
SCHEMBL7842886 0.89 SRC (0.69) SRCEGFRABL1ABL2CDK1
SCHEMBL7844695 0.88 SRC (0.68) SRCEGFRABL1ABL2CDK1
SCHEMBL7846544 0.88 SRC (0.74) SRCEGFRABL1ABL2CDK1
SCHEMBL7846032 0.86 SRC (0.67) SRCEGFRABL1ABL2CDK1
SCHEMBL7847983 0.86 SRC (0.68) SRCEGFRABL1ABL2CDK1
SCHEMBL7833916 0.86 SRC (0.68) SRCEGFRABL1ABL2CDK1
SCHEMBL7846289 0.86 SRC (0.55) SRCEGFRABL1ABL2CDK1
SCHEMBL7842398 0.85 SRC (0.64) 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