SCHEMBL16722915

SCHEMBL16722915

CC(=O)N1C2CCC(C3CCC(S(C)(=O)=O)CC3)CC2N(C(=O)OC2CCC(C)CC2)C[C@@H]1C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 2/20 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
SCHEMBL16722928 0.93 HCRTR2 (0.32) HCRTR2
SCHEMBL16722936 0.92 — —
SCHEMBL16722920 0.92 HCRTR2 (0.34) HCRTR2
SCHEMBL16722922 0.85 TSHR (0.41) HCRTR2
SCHEMBL16722956 0.85 HCRTR2 (0.30) HCRTR2
SCHEMBL16722917 0.83 HCRTR2 (0.31) HCRTR2
SCHEMBL16722958 0.81 — —
SCHEMBL16722942 0.80 — —
SCHEMBL16722960 0.80 — —
SCHEMBL16722961 0.80 — —

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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