SCHEMBL17550617

SCHEMBL17550617

COc1cc([C@@H](C)N(C(=O)[C@H]2CNCCO2)C2CC2)cc(CCCNC(=O)O)n1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.88

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
SCHEMBL19512218 1.00 REN (0.88) REN
SCHEMBL15418862 1.00 REN (0.88) REN
SCHEMBL19512226 0.94 REN (1.00) REN
SCHEMBL16471605 0.94 REN (1.00) REN
SCHEMBL16471602 0.94 REN (1.00) REN
SCHEMBL19512233 0.94 REN (1.00) REN
SCHEMBL15417904 0.93 REN (0.87) REN
SCHEMBL15417992 0.92 REN (0.89) REN
SCHEMBL15417947 0.91 REN (0.88) REN
SCHEMBL15417909 0.90 REN (0.85) REN

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2687518-B1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2017-11-01 — — EP claimed
US-9278944-B2 Nitrogen-containing saturated heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-03-08 — — US claimed
EP-2687518-B1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2017-11-01 — — EP disclosed
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