SCHEMBL7853258

SCHEMBL7853258

CC(C(=O)NCCSCCO)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc21

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TEK Q02763 10/20 0.61
KDR P35968 9/20 0.61
LCK P06239 9/20 0.61
SRC P12931 4/20 0.61
HCK P08631 8/20 0.50
FLT3 P36888 6/20 0.50
EGFR P00533 1/20 0.48

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
SCHEMBL7855241 0.88 TEK (0.63) TEKKDRLCKSRCHCK
SCHEMBL7852094 0.88 TEK (0.62) TEKKDRLCKSRCHCK
SCHEMBL6463560 0.87 TEK (0.63) TEKKDRLCKSRCHCK
SCHEMBL7853088 0.86 TEK (0.62) TEKKDRLCKSRCHCK
SCHEMBL7852443 0.85 TEK (0.66) TEKKDRLCKSRCHCK
SCHEMBL7852446 0.85 TEK (0.66) TEKKDRLCKSRCHCK
SCHEMBL7842851 0.85 TEK (0.60) TEKKDRLCKSRCHCK
SCHEMBL7850705 0.84 TEK (0.64) TEKKDRLCKSRCHCK
SCHEMBL7850701 0.84 TEK (0.64) TEKKDRLCKSRCHCK
SCHEMBL7851572 0.84 TEK (0.64) TEKKDRLCKSRCHCK

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-1114053-A1 PYRROLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-07-11 EP disclosed
WO-2000017203-A1 PYRROLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2000-03-30 WO disclosed