SCHEMBL25061397

SCHEMBL25061397

CC1(C)c2ccccc2-c2ccc(N(c3cccc(-c4cccc5c4-c4ccccc4C5(C)C)c3)c3cccc4oc5ccccc5c34)cc21

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 3/20 0.33

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
SCHEMBL38651598 1.00 ALK (0.33) ALK
SCHEMBL24968669 0.95 ALK (0.33) ALK
SCHEMBL22182409 0.95 ALK (0.32) ALK
SCHEMBL25061383 0.93 ALK (0.33) ALK
SCHEMBL24968691 0.93 ALK (0.34) ALK
SCHEMBL26065046 0.92 ALK (0.32) ALK
SCHEMBL23376139 0.92 ALK (0.33) ALK
SCHEMBL24840341 0.91 ALK (0.32) ALK
SCHEMBL26601884 0.91 ALK (0.33) ALK
SCHEMBL26279541 0.91 ALK (0.32) ALK

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-20230058635-A1 ELECTRONIC DEVICE MERCK PATENT GMBH (DE) 2023-02-23 US disclosed