SCHEMBL7022376

SCHEMBL7022376

COc1cccc(-c2cn(C3CCN(CCn4ccnc4)C3)c3ncnc(N)c23)c1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 19/20 0.69
EGFR P00533 19/20 0.69
ABL2 P42684 19/20 0.69
SRC P12931 18/20 0.69
LCK P06239 4/20 0.64

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
SCHEMBL7017741 0.95 EGFR (0.75) ABL1EGFRABL2SRCLCK
SCHEMBL7015260 0.91 SRC (0.60) ABL1EGFRABL2SRCLCK
SCHEMBL7022341 0.88 ABL1 (0.69) ABL1EGFRABL2SRCLCK
SCHEMBL7014534 0.88 SRC (0.59) ABL1EGFRABL2SRCLCK
SCHEMBL7023975 0.86 EGFR (0.76) ABL1EGFRABL2SRCLCK
SCHEMBL8107232 0.86 ABL1 (0.78) ABL1EGFRABL2SRCLCK
SCHEMBL7018756 0.86 SRC (0.65) ABL1EGFRABL2SRCLCK
SCHEMBL7016791 0.83 ABL1 (0.75) ABL1EGFRABL2SRCLCK
SCHEMBL7017737 0.83 SRC (0.58) ABL1EGFRABL2SRCLCK
SCHEMBL7018218 0.83 SRC (0.64) ABL1EGFRABL2SRCLCK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888353-B1 N-7-HETEROCYCLYL PYRROLO [2,3-d]PYRIMIDINES AND THEIR USE NOVARTIS AG (CH) 2003-07-09 EP claimed
US-6051577-A TYROSINE INHIBITORS; BONE DISORDERS NOVARTIS AG (CH) 2000-04-18 US disclosed