SCHEMBL21078166

SCHEMBL21078166

CCCCC1(CC)CCCCN1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.30

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
SCHEMBL5585816 0.94 GAA (0.31) GAA
SCHEMBL18431969 0.91 GAA (0.33) GAA
Water SCHEMBL997645 0.88 GAA (0.30) GAA
SCHEMBL5585359 0.88
SCHEMBL27635335 0.86 GAA (0.34) GAA
SCHEMBL27656285 0.86 GAA (0.34) GAA
SCHEMBL27695745 0.86 GAA (0.34) GAA
SCHEMBL27715726 0.86 GAA (0.34) GAA
SCHEMBL5585356 0.85 GAA (0.32) GAA
SCHEMBL5975141 0.83 GAA (0.34) GAA

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-3041841-B1 TRIAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF HOFFMANN LA ROCHE (CH) 2019-06-05 EP disclosed