SCHEMBL7876397

SCHEMBL7876397

C[C@H](Nc1nccc(-n2cnc3ccccc32)n1)[C@@H]1CN(C(=O)Nc2cccc3ccccc23)CCN1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LCK P06239 20/20 0.76

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
SCHEMBL7566558 1.00 LCK (0.76) LCK
SCHEMBL7566568 1.00 LCK (0.76) LCK
SCHEMBL7541695 1.00 LCK (0.76) LCK
SCHEMBL7495391 0.87 LCK (1.00) LCK
SCHEMBL7503485 0.87 LCK (1.00) LCK
SCHEMBL7874530 0.87 LCK (1.00) LCK
SCHEMBL7544230 0.85 LCK (0.76) LCK
SCHEMBL7873114 0.84 LCK (1.00) LCK
SCHEMBL7873113 0.84 LCK (1.00) LCK
SCHEMBL7492353 0.84 LCK (0.69) 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