SCHEMBL3406236

SCHEMBL3406236

CCOC(=O)Oc1sc(N2CC[C@@H](NC(=O)c3[nH]c(C)c(Cl)c3C#N)[C@@H](OC)C2)nc1-c1cn(C)cn1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ABCC2 Q92887 1/20 0.48

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
SCHEMBL3400996 0.93 ABCC2 (0.52) ABCC2
SCHEMBL3405603 0.92 ABCC2 (0.56) ABCC2
SCHEMBL3402888 0.90 ABCC2 (0.51) ABCC2
SCHEMBL3434364 0.90 — —
SCHEMBL3402029 0.90 — —
SCHEMBL3403562 0.89 — —
SCHEMBL3406545 0.89 — —
SCHEMBL3403525 0.88 — —
SCHEMBL3403956 0.87 — —
SCHEMBL3406872 0.85 — —

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
EP-2158199-B1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2010-11-17 — — EP claimed
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