SCHEMBL7876873

SCHEMBL7876873

CN1CCN(C(=O)Nc2cccc3ccccc23)CC1CCNc1nccc(-n2cnc3cc(-c4ccncc4)ccc32)n1

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
SCHEMBL7577238 0.88 LCK (0.66) LCK
SCHEMBL7867787 0.85 LCK (1.00) LCK
SCHEMBL7539233 0.85 LCK (1.00) LCK
SCHEMBL7876870 0.83 LCK (0.70) LCK
SCHEMBL7547666 0.83 LCK (0.74) LCK
SCHEMBL7569953 0.80 LCK (0.81) LCK
SCHEMBL7542545 0.79 LCK (0.88) LCK
SCHEMBL7874599 0.77 LCK (0.84) LCK
SCHEMBL7506504 0.77 LCK (0.60) LCK
SCHEMBL7505858 0.77 LCK (0.55) 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