SCHEMBL7876870

SCHEMBL7876870

CCN(c1nccc(-n2cnc3cc(-c4ccncc4)ccc32)n1)C1CN(C(=O)Nc2cccc3ccccc23)CCN1C

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LCK P06239 20/20 0.70

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
SCHEMBL7876873 0.83 LCK (0.75) LCK
SCHEMBL7867787 0.83 LCK (1.00) LCK
SCHEMBL7539233 0.83 LCK (1.00) LCK
SCHEMBL7547667 0.81 LCK (0.69) LCK
SCHEMBL7569953 0.77 LCK (0.81) LCK
SCHEMBL7577238 0.77 LCK (0.66) LCK
SCHEMBL7542545 0.76 LCK (0.88) LCK
SCHEMBL7493943 0.76 LCK (0.59) LCK
SCHEMBL7874599 0.74 LCK (0.84) LCK
SCHEMBL7873009 0.74 LCK (0.78) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6316444-B1 SRC kinase inhibitor compounds MERCK & CO., INC. 2001-11-13 US disclosed