SCHEMBL16104151

SCHEMBL16104151

C=C1/C=C\C=C/CCCCC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 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
SCHEMBL8763101 0.83
SCHEMBL8763092 0.83
SCHEMBL8763984 0.83 ALDH1A1 (0.39) ALDH1A1
SCHEMBL8763991 0.83 ALDH1A1 (0.39) ALDH1A1
SCHEMBL8763215 0.80
SCHEMBL18691951 0.73 ALDH1A1 (0.56) ALDH1A1
SCHEMBL28890799 0.73 ALDH1A1 (0.56) ALDH1A1
SCHEMBL1009832 0.73 ALDH1A1 (0.56) ALDH1A1
SCHEMBL19743473 0.73 ALDH1A1 (0.56) ALDH1A1
SCHEMBL11084269 0.73 ALDH1A1 (0.56) ALDH1A1

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-2019671-B1 INTERMEDIATES FOR THE PREPARATION OF BIVALENT SMAC MIMETICS UNIV MICHIGAN (US) 2014-09-24 EP disclosed