SCHEMBL7290882

SCHEMBL7290882

COc1ccc(N2CC(CCN3CCC(c4ccc5c(c4)OCO5)CC3)OC2=O)cc1OC

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 12/20 0.67
ACHE P22303 2/20 0.47
KCNH2 Q12809 3/20 0.47
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL7291135 0.91 SIGMAR1 (0.80) SIGMAR1ACHEKCNH2
SCHEMBL7290395 0.90 SIGMAR1 (0.83) SIGMAR1SMN1; SMN2
SCHEMBL7291745 0.88 SIGMAR1 (0.70) SIGMAR1KCNH2
SCHEMBL7293138 0.87 SIGMAR1 (0.61) SIGMAR1ACHEKCNH2POLBCYP3A4
SCHEMBL7291491 0.85 SIGMAR1 (0.65) SIGMAR1KCNH2
SCHEMBL7290629 0.85 SIGMAR1 (0.65) SIGMAR1
SCHEMBL7299514 0.85 SIGMAR1 (0.64) SIGMAR1
SCHEMBL7298256 0.84 SIGMAR1 (0.70) SIGMAR1LMNA
SCHEMBL7298734 0.81 SIGMAR1 (0.57) SIGMAR1KCNH2LMNA
SCHEMBL7300307 0.80 SIGMAR1 (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0459256-B1 Oxazolidinones with CNS-depressant activity MERCK PATENT GMBH (DE) 1995-07-12 EP disclosed
US-5232931-A OXAZOLIDINONES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-08-03 US disclosed
EP-0459256-A1 Oxazolidinones with CNS-depressant activity MERCK PATENT GmbH (DE) 1991-12-04 EP disclosed