SCHEMBL19249706

SCHEMBL19249706

NC1CCCN(C(=O)C2CC2)[C@H]1CO[C@H]1CC[C@@H](c2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 20/20 0.69

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
SCHEMBL24044338 1.00 HCRTR2 (0.69) HCRTR2
SCHEMBL24044553 1.00 HCRTR2 (0.69) HCRTR2
SCHEMBL24799823 0.93 HCRTR2 (0.63) HCRTR2
SCHEMBL24044557 0.93 HCRTR2 (0.71) HCRTR2
SCHEMBL24044758 0.92 HCRTR2 (0.71) HCRTR2
SCHEMBL22064470 0.91 HCRTR2 (0.61) HCRTR2
SCHEMBL22064469 0.91 HCRTR2 (0.61) HCRTR2
SCHEMBL24044787 0.91 HCRTR2 (0.69) HCRTR2
SCHEMBL24044629 0.90 HCRTR2 (0.71) HCRTR2
SCHEMBL24044381 0.89 HCRTR2 (0.72) 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
WO-2017135306-A1 SUBSTITUTED PIPERIDINE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-08-10 — — WO disclosed
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