SCHEMBL18673418

SCHEMBL18673418

CN1CC[C@@](O)(C#Cc2cccc(-n3nc(C(N)=O)c4cc(CO)ccc43)c2)C1O

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MAP3K14 Q99558 20/20 0.71

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
SCHEMBL18673365 0.87 MAP3K14 (0.72) MAP3K14
SCHEMBL16516768 0.83 MAP3K14 (1.00) MAP3K14
SCHEMBL16532526 0.83 MAP3K14 (1.00) MAP3K14
SCHEMBL18673419 0.77 MAP3K14 (0.73) MAP3K14
SCHEMBL17921006 0.77 MAP3K14 (0.74) MAP3K14
SCHEMBL16532264 0.75 MAP3K14 (1.00) MAP3K14
SCHEMBL16532287 0.74 MAP3K14 (1.00) MAP3K14
SCHEMBL16516391 0.74 MAP3K14 (0.83) MAP3K14
SCHEMBL16532564 0.74 MAP3K14 (0.81) MAP3K14
SCHEMBL16532566 0.74 MAP3K14 (0.81) MAP3K14

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-9605005-B2 Alkynyl alcohols and methods of use GENENTECH, INC. (US) 2017-03-28 — — US disclosed
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