SCHEMBL7551010

SCHEMBL7551010

CC(Nc1nccc(-n2cnc3cc(NC(=O)OC(C)(C)C)ccc32)n1)C1CCCN(C(=O)Nc2ccccc2)C1

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LCK P06239 20/20 0.75

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
SCHEMBL7553602 0.91 LCK (0.76) LCK
SCHEMBL7547222 0.89 LCK (0.76) LCK
SCHEMBL7556006 0.87 LCK (0.83) LCK
SCHEMBL7591203 0.86 LCK (1.00) LCK
SCHEMBL7570274 0.85 LCK (0.56) LCK
SCHEMBL7987452 0.85 LCK (0.80) LCK
SCHEMBL7510219 0.84 LCK (0.77) LCK
SCHEMBL7590572 0.83 LCK (0.52) LCK
SCHEMBL7549142 0.83 LCK (0.72) LCK
SCHEMBL7983346 0.83 LCK (0.89) LCK

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-1206260-A4 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO INC (US) 2002-10-30 EP disclosed
EP-1206260-A1 SRC KINASE INHIBITOR COMPOUNDS Merck & Co., Inc. (US) 2002-05-22 EP disclosed
US-6329380-B1 PYRIMIDINE BENZIMIDIZAZOLE, PYRIMIDINEIMIDAZOLE OR PYRIDINE IMIDAZOLE COMPOUNDS FOR ANTICANCER AGENTS OR ATHEROSCLEROSIS MERCK & CO., INC. 2001-12-11 US disclosed
WO-2001000207-A1 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO., INC. (US) 2001-01-04 WO disclosed