SCHEMBL7018784

SCHEMBL7018784

NC(=O)CN1CCC(n2cc(-c3cccc(O)c3)c3c(N)ncnc32)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 17/20 1.00
EGFR P00533 16/20 1.00
SRC P12931 16/20 1.00
ABL2 P42684 15/20 1.00
LCK P06239 7/20 1.00
RET P07949 4/20 0.72
IGF1R P08069 4/20 0.72
JAK2 O60674 3/20 0.72
INSR P06213 3/20 0.72
KIT P10721 3/20 0.72
PDGFRA P16234 3/20 0.72
FGFR4 P22455 3/20 0.72
FGFR3 P22607 3/20 0.72
KDR P35968 3/20 0.72
ALK Q9UM73 3/20 0.72
KIF5B P33176 3/20 0.72
NTRK1 P04629 2/20 0.72
NPM1 P06748 2/20 0.72
CSF1R P07333 2/20 0.72
LYN P07948 2/20 0.72

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
SCHEMBL7019164 0.95 ABL1 (1.00) ABL1EGFRSRCABL2LCK
SCHEMBL7014326 0.93 ABL1 (0.86) ABL1EGFRSRCABL2LCK
SCHEMBL7020520 0.89 ABL1 (1.00) ABL1EGFRSRCABL2LCK
SCHEMBL7016560 0.89 ABL1 (1.00) ABL1EGFRSRCABL2LCK
SCHEMBL7016766 0.88 ABL1 (1.00) ABL1EGFRSRCABL2LCK
SCHEMBL8108556 0.87 ABL1 (1.00) ABL1EGFRSRCABL2LCK
SCHEMBL8107017 0.85 ABL1 (0.83) ABL1EGFRSRCABL2LCK
SCHEMBL7014978 0.85 ABL1 (0.92) ABL1EGFRSRCABL2LCK
SCHEMBL7021411 0.84 ABL1 (1.00) ABL1EGFRSRCABL2LCK
SCHEMBL12438228 0.84 ABL1 (1.00) ABL1EGFRSRCABL2LCK

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-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
CN-1216544-A Novel N-7-heterocyclyl pyrrolo [2,3-D] pyridines and their use NOVARTIS AG (CH) 1999-05-12 CN disclosed