SCHEMBL20004287

SCHEMBL20004287

CC1(C)c2cc(OCC(O)CCO)ccc2C(=O)c2c1oc1cccnc21

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.65

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
SCHEMBL20366786 1.00 ALK (0.65) ALK
SCHEMBL897190 0.90 ALK (0.68) ALK
SCHEMBL20366785 0.86 ALK (0.65) ALK
SCHEMBL20004554 0.86 ALK (0.65) ALK
SCHEMBL20004424 0.83 ALK (0.66) ALK
SCHEMBL20366792 0.83 ALK (0.66) ALK
SCHEMBL20366789 0.83 ALK (0.66) ALK
SCHEMBL20004948 0.83 ALK (0.66) ALK
SCHEMBL897300 0.82 ALK (0.53) ALK
SCHEMBL25445434 0.80 ALK (0.72) 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