SCHEMBL7014534

SCHEMBL7014534

Nc1ncnc2c1c(-c1ccccc1)cn2C1CCN(CCn2ccnc2)C1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 15/20 0.59
EGFR P00533 13/20 0.57
ABL1 P00519 11/20 0.57
ABL2 P42684 11/20 0.57
BTK Q06187 2/20 0.56
RIPK2 O43353 1/20 0.55
LCK P06239 2/20 0.54

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
SCHEMBL7018218 0.95 SRC (0.64) SRCEGFRABL1ABL2BTK
SCHEMBL7017737 0.91 SRC (0.58) SRCEGFRABL1ABL2BTK
SCHEMBL7022341 0.90 ABL1 (0.69) SRCEGFRABL1ABL2BTK
SCHEMBL7015260 0.89 SRC (0.60) SRCEGFRABL1ABL2BTK
SCHEMBL7022376 0.88 ABL1 (0.69) SRCEGFRABL1ABL2LCK
SCHEMBL7019270 0.86 SRC (0.63) SRCEGFRABL1ABL2RIPK2
SCHEMBL7023713 0.85 SRC (0.72) SRCEGFRABL1ABL2BTK
SCHEMBL7016791 0.84 ABL1 (0.75) SRCEGFRABL1ABL2BTK
SCHEMBL8107889 0.84 SRC (0.64) SRCEGFRABL1ABL2BTK
SCHEMBL7018756 0.83 SRC (0.65) SRCEGFRABL1ABL2RIPK2

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