SCHEMBL18531982

SCHEMBL18531982

CC(=O)N(C(C)CCC(C)N(S)C1CC1)C1CC1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.33

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
SCHEMBL18531991 0.86 PIK3CD (0.33) PIK3CD
SCHEMBL18532047 0.83 PIK3CD (0.33) PIK3CD
SCHEMBL2736120 0.82 CHRNB2 (0.39) PIK3CD
SCHEMBL13780938 0.81 PIK3CD (0.32) PIK3CD
SCHEMBL2736122 0.81 PIK3CD (0.33) PIK3CD
SCHEMBL18532019 0.80 PIK3CD (0.31) PIK3CD
SCHEMBL2736124 0.78 ALDH1A1 (0.33) PIK3CD
SCHEMBL13780659 0.77 PIK3CD (0.33) PIK3CD
SCHEMBL18531962 0.77 ACACB (0.36)
SCHEMBL18576496 0.76 PIK3CD (0.37) PIK3CD

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-9575080-B2 2017-02-21 US disclosed