SCHEMBL5139588

SCHEMBL5139588

COC(=O)c1cnc(N2CCCC(NC(=O)c3[nH]c(C)c(Cl)c3Cl)CC2)s1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ABCC2 Q92887 1/20 0.63

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
SCHEMBL3285193 0.96 ABCC2 (0.67) ABCC2
SCHEMBL3281617 0.89 ABCC2 (0.71) ABCC2
SCHEMBL3281601 0.87 ABCC2 (0.65) ABCC2
SCHEMBL4128296 0.87 ABCC2 (0.64) ABCC2
SCHEMBL3281751 0.86 ABCC2 (0.60) ABCC2
SCHEMBL3281644 0.85 ABCC2 (0.62) ABCC2
SCHEMBL3282291 0.84 ABCC2 (0.52) ABCC2
SCHEMBL3285132 0.84 ABCC2 (0.60) ABCC2
SCHEMBL15122257 0.83 ABCC2 (0.55) ABCC2
SCHEMBL15121848 0.83 ABCC2 (0.74) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008020227-A2 ANTIBACTERIAL PYRROLECARBOXAMIDES ASTRAZENECA AB (SE) 2008-02-21 — — WO disclosed
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