SCHEMBL17065221

SCHEMBL17065221

CC1CCC(C(C)C[K])CC1=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
KMT2A Q03164 1/20 0.31
PIK3CD O00329 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
SCHEMBL23817259 0.81 CA1 (0.32) CA1CA2CA4KMT2APIK3CD
SCHEMBL812088 0.78 CA1 (0.38) CA1CA2CA4KMT2APIK3CD
SCHEMBL20608621 0.78 CA1 (0.38) CA1CA2CA4KMT2APIK3CD
SCHEMBL2007153 0.74 PTGS1 (0.38) CA1CA2CA4KMT2A
SCHEMBL23817258 0.74
SCHEMBL23801847 0.74
SCHEMBL23718708 0.70
SCHEMBL19624810 0.64
SCHEMBL12199100 0.64
SCHEMBL24316169 0.64

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
WO-2015134811-A1 FUNCTIONALIZED PRIMARY ALKYLTRIFLUOROBORATE SALTS SAN DIEGO STATE UNIVERSITY FOUNDATION (US) 2015-09-11 WO disclosed