SCHEMBL9677353

SCHEMBL9677353

COc1ccc(N2CC(CN3CCC(O)(c4ccc(OC)cc4)CC3)OC2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 20/20 1.00

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
SCHEMBL9677344 0.96 SIGMAR1 (0.92) SIGMAR1
SCHEMBL9676885 0.95 SIGMAR1 (1.00) SIGMAR1
SCHEMBL9676257 0.95 SIGMAR1 (1.00) SIGMAR1
SCHEMBL9676450 0.95 SIGMAR1 (1.00) SIGMAR1
SCHEMBL9676413 0.95 SIGMAR1 (1.00) SIGMAR1
SCHEMBL9677127 0.95 SIGMAR1 (0.92) SIGMAR1
SCHEMBL9677099 0.95 SIGMAR1 (1.00) SIGMAR1
SCHEMBL9677736 0.91 SIGMAR1 (0.90) SIGMAR1
SCHEMBL9678606 0.91 SIGMAR1 (0.83) SIGMAR1
SCHEMBL9844410 0.90 SIGMAR1 (0.81) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300272-B1 OXAZOLIDINONES MERCK PATENT GmbH (DE) 1992-09-16 EP claimed
US-4970217-A NEUROLEPTIC MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-11-13 US claimed
EP-0300272-A1 Oxazolidinones MERCK PATENT GmbH (DE) 1989-01-25 EP claimed
EP-0300272-B1 OXAZOLIDINONES MERCK PATENT GmbH (DE) 1992-09-16 EP disclosed
US-4970217-A NEUROLEPTIC MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-11-13 US disclosed
EP-0300272-A1 Oxazolidinones MERCK PATENT GmbH (DE) 1989-01-25 EP disclosed