SCHEMBL24044387

SCHEMBL24044387

N#CCC(=O)N1CCC[C@H](N)[C@@H]1CO[C@H]1CC[C@@H](c2ccccc2)CC1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 20/20 0.71

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
SCHEMBL24044794 0.88 HCRTR2 (0.69) HCRTR2
SCHEMBL24044629 0.87 HCRTR2 (0.71) HCRTR2
SCHEMBL24044630 0.85 HCRTR2 (0.75) HCRTR2
SCHEMBL24044594 0.85 HCRTR2 (0.58) HCRTR2
SCHEMBL24044533 0.85 HCRTR2 (0.72) HCRTR2
SCHEMBL24044468 0.84 HCRTR2 (0.72) HCRTR2
SCHEMBL24044482 0.84 HCRTR2 (0.70) HCRTR2
SCHEMBL24044765 0.84 HCRTR2 (0.71) HCRTR2
SCHEMBL24044694 0.84 HCRTR2 (0.72) HCRTR2
SCHEMBL24044553 0.83 HCRTR2 (0.69) HCRTR2

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
EP-3411358-B1 SUBSTITUTED PIPERIDINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2021-11-24 — — EP disclosed
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