SCHEMBL18673444

SCHEMBL18673444

CN1CC[C@@](O)(C#Cc2cccc(-n3nc(C(N)=O)c4c3OC(C)(C)C(F)(F)C4)c2)C1=O

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
SCHEMBL18888159 0.87 MAP3K14 (0.85) MAP3K14
SCHEMBL17922404 0.86 MAP3K14 (0.74) MAP3K14
SCHEMBL17922403 0.86 MAP3K14 (0.74) MAP3K14
SCHEMBL16532317 0.83 MAP3K14 (1.00) MAP3K14
SCHEMBL16517641 0.83 MAP3K14 (1.00) MAP3K14
SCHEMBL16532270 0.83 MAP3K14 (1.00) MAP3K14
SCHEMBL16517299 0.81 MAP3K14 (1.00) MAP3K14
SCHEMBL16517302 0.81 MAP3K14 (1.00) MAP3K14
SCHEMBL16532302 0.81 MAP3K14 (1.00) MAP3K14
SCHEMBL16534199 0.81 MAP3K14 (1.00) 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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