SCHEMBL17090022

SCHEMBL17090022

Cc1cc(NC[C@H]2CC[C@H](NS(=O)(=O)C(C)C)CC2)cc2ccc(=O)oc12

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GRIA2 P42262 7/20 0.35
▸ NPY5R Q15761 6/20 0.35
▸ MET P08581 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
SCHEMBL13565587 1.00 GRIA2 (0.35) GRIA2NPY5RMET
SCHEMBL17090116 0.83 ALDH1A1 (0.45) —
SCHEMBL13439121 0.82 DRD2 (0.31) MET
SCHEMBL10114793 0.82 MEN1 (0.39) GRIA2
SCHEMBL14424768 0.82 MEN1 (0.39) GRIA2
SCHEMBL13565472 0.78 GRIA2 (0.35) GRIA2NPY5R
SCHEMBL11935351 0.76 CA12 (0.50) —
SCHEMBL13566008 0.76 NPY5R (0.33) GRIA2NPY5R
SCHEMBL11941123 0.76 CA12 (0.50) —
SCHEMBL17090379 0.76 NPY5R (0.33) GRIA2NPY5R

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-9139518-B2 Amine derivative having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2015-09-22 — — US disclosed
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