SCHEMBL16722949

SCHEMBL16722949

CC(=O)N1C2CCC(C3CCC(S(C)(=O)=O)CC3)CC2N(C(=O)CC2CCCC2)C[C@@H]1C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 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
SCHEMBL16722956 0.85 HCRTR2 (0.30) HCRTR2
SCHEMBL16722916 0.85 HCRTR2 (0.34) HCRTR2
SCHEMBL16722928 0.84 HCRTR2 (0.32) HCRTR2
SCHEMBL16722920 0.83 HCRTR2 (0.34) HCRTR2
SCHEMBL16722934 0.81 GAA (0.40) —
SCHEMBL16722922 0.81 TSHR (0.41) HCRTR2
SCHEMBL16722960 0.80 — —
SCHEMBL16722942 0.80 — —
SCHEMBL16722961 0.80 — —
SCHEMBL16722940 0.79 — —

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-2015074081-A1 BENZOPIPERAZINE COMPOSITIONS AS BET BROMODOMAIN INHIBITORS BAIR KENNETH W (US) 2015-05-21 — — WO disclosed
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