SCHEMBL7569772

SCHEMBL7569772

CCN(c1nccc(-n2cnc3ccccc32)n1)C1CCCN(C(=O)Nc2cccc(Cl)c2)C1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LCK P06239 17/20 0.55
CDK2 P24941 1/20 0.48
MKNK2 Q9HBH9 1/20 0.42

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
SCHEMBL7579034 0.92 LCK (0.57) LCKMKNK2
SCHEMBL7507614 0.86 LCK (0.56) LCKMKNK2
SCHEMBL7515352 0.82 LCK (0.67) LCKMKNK2
SCHEMBL7593210 0.81 LCK (0.84) LCKCDK2
SCHEMBL7506201 0.80 LCK (0.58) LCKCDK2MKNK2
SCHEMBL7502002 0.78 LCK (0.66) LCKMKNK2
SCHEMBL7570454 0.77 LCK (0.62) LCKMKNK2
SCHEMBL7588831 0.76 LCK (0.69) LCK
SCHEMBL7512884 0.75 LCK (0.51) LCKMKNK2
SCHEMBL7506412 0.75 MKNK1 (0.50) LCKMKNK2

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 3 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
WO-2001000207-A1 SRC KINASE INHIBITOR COMPOUNDS MERCK & CO., INC. (US) 2001-01-04 WO disclosed