SCHEMBL5258227

SCHEMBL5258227

COC1CN(c2nc(C)c(C(=O)O)s2)CCC1NC(=O)c1[nH]c(C)c(Cl)c1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ABCC2 Q92887 1/20 0.76

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
SCHEMBL3122640 1.00 ABCC2 (0.76) ABCC2
SCHEMBL5258232 1.00 ABCC2 (0.76) ABCC2
SCHEMBL13248306 0.92 ABCC2 (0.82) ABCC2
SCHEMBL15121990 0.92 ABCC2 (0.82) ABCC2
SCHEMBL3120803 0.91 ABCC2 (0.67) ABCC2
SCHEMBL3240863 0.91 ABCC2 (0.71) ABCC2
SCHEMBL3240869 0.91 ABCC2 (0.71) ABCC2
SCHEMBL3119818 0.91 ABCC2 (0.75) ABCC2
SCHEMBL3111124 0.91 ABCC2 (0.80) ABCC2
SCHEMBL15122313 0.91 ABCC2 (0.75) ABCC2

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-1853586-B1 ANTIBACTERIAL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2013-07-24 — — EP disclosed
EP-1853586-A1 ANTIBACTERIAL PIPERIDINE DERIVATIVES AstraZeneca AB (SE) 2007-11-14 — — EP disclosed
WO-2006087543-A1 ANTIBACTERIAL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2006-08-24 — — WO disclosed
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