SCHEMBL7019904

SCHEMBL7019904

Nc1ncnc2c1c(-c1ccc(O)cc1)cn2C1CCNC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SRC P12931 17/20 1.00
EGFR P00533 8/20 1.00
ABL1 P00519 7/20 1.00
ABL2 P42684 7/20 1.00
LCK P06239 2/20 0.73
RIPK2 O43353 1/20 0.71
FGR P09769 1/20 0.67
EPHA1 P21709 1/20 0.67
TXK P42681 1/20 0.67
FRK P42685 1/20 0.67
PTK6 Q13882 1/20 0.67
TEK Q02763 1/20 0.63
RET P07949 1/20 0.56
KIF5B P33176 1/20 0.56
KDR P35968 1/20 0.56

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
Hydrochloric Acid SCHEMBL8107815 0.99 SRC (0.98) SRCEGFRABL1ABL2LCK
SCHEMBL7020106 0.93 SRC (0.87) SRCEGFRABL1ABL2LCK
SCHEMBL8114105 0.89 SRC (1.00) SRCEGFRABL1ABL2LCK
SCHEMBL7021405 0.87 SRC (1.00) SRCEGFRABL1ABL2LCK
Hydrochloric Acid SCHEMBL8114119 0.85 SRC (0.98) SRCEGFRABL1ABL2LCK
SCHEMBL6865210 0.84 SRC (1.00) SRCEGFRABL1ABL2LCK
SCHEMBL14617844 0.84 SRC (1.00) SRCEGFRABL1ABL2LCK
Hydrochloric Acid SCHEMBL6462081 0.83 SRC (0.98) SRCEGFRABL1ABL2LCK
Hydrochloric Acid SCHEMBL8108614 0.82 SRC (0.78) SRCEGFRABL1ABL2LCK
SCHEMBL13020337 0.82 SRC (0.72) 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