SCHEMBL21443210

SCHEMBL21443210

CC(CO)COc1ccc2c(c1)C(C)(C)c1oc3ccccc3c1C2=O

nearest known ligand 0.82

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.82

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
SCHEMBL898530 0.90 ALK (1.00) ALK
SCHEMBL29961926 0.90 ALK (1.00) ALK
SCHEMBL10283154 0.90 ALK (1.00) ALK
SCHEMBL29963188 0.90 ALK (1.00) ALK
SCHEMBL898567 0.90 ALK (1.00) ALK
SCHEMBL898539 0.89 ALK (0.84) ALK
SCHEMBL29962704 0.89 ALK (0.84) ALK
SCHEMBL20366813 0.89 ALK (0.84) ALK
SCHEMBL17448499 0.89 ALK (0.84) ALK
SCHEMBL20004952 0.88 ALK (0.64) 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
EP-3345903-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2019-10-09 EP disclosed