SCHEMBL20004972

SCHEMBL20004972

Cc1ccc2c3c(oc2c1)C(C)(C)c1cc(OCC(O)C(O)CO)ccc1C3=O

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.83

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
SCHEMBL20366741 1.00 ALK (0.83) ALK
SCHEMBL897628 0.91 ALK (0.86) ALK
SCHEMBL20366540 0.91 ALK (0.86) ALK
SCHEMBL898534 0.91 ALK (0.83) ALK
SCHEMBL10283139 0.91 ALK (1.00) ALK
SCHEMBL24676305 0.91 ALK (1.00) ALK
SCHEMBL7808669 0.91 ALK (0.83) ALK
SCHEMBL898376 0.91 ALK (1.00) ALK
SCHEMBL10283159 0.91 ALK (0.83) ALK
SCHEMBL20004533 0.91 ALK (0.86) 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-2975024-B1 TETRACYCLIC COMPOUNDS CHUGAI PHARMACEUTICAL CO LTD (JP) 2018-03-28 EP disclosed