SCHEMBL7023713

SCHEMBL7023713

Nc1ncnc2c1c(-c1ccccc1)cn2C1CCN(CCO)C1

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SRC P12931 14/20 0.72
EGFR P00533 11/20 0.72
ABL1 P00519 9/20 0.72
ABL2 P42684 9/20 0.72
LCK P06239 1/20 0.72
HCK P08631 1/20 0.64
BTK Q06187 2/20 0.63
RIPK2 O43353 1/20 0.63

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
SCHEMBL7020164 0.94 SRC (0.81) SRCEGFRABL1ABL2LCK
SCHEMBL8099110 0.91 SRC (0.71) SRCEGFRABL1ABL2LCK
SCHEMBL7023786 0.90 ABL1 (0.89) SRCEGFRABL1ABL2LCK
SCHEMBL7017495 0.90 SRC (0.61) SRCEGFRABL1ABL2LCK
SCHEMBL8107889 0.89 SRC (0.64) SRCEGFRABL1ABL2LCK
SCHEMBL8098878 0.88 SRC (0.63) SRCEGFRABL1ABL2LCK
SCHEMBL7014534 0.85 SRC (0.59) SRCEGFRABL1ABL2LCK
SCHEMBL8107249 0.84 SRC (0.80) SRCEGFRABL1ABL2LCK
SCHEMBL8108556 0.84 ABL1 (1.00) SRCEGFRABL1ABL2LCK
SCHEMBL8114235 0.83 SRC (0.71) SRCEGFRABL1ABL2LCK

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 disclosed
US-6051577-A TYROSINE INHIBITORS; BONE DISORDERS NOVARTIS AG (CH) 2000-04-18 US disclosed