SCHEMBL3400518

SCHEMBL3400518

CO[C@H]1CN(c2nc(-c3csc(N(C)C)n3)c(OC(=O)O)s2)CC[C@H]1NC(=O)c1[nH]c(C)c(Cl)c1Cl

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ABCC2 Q92887 1/20 0.58

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
SCHEMBL3399656 0.95 ABCC2 (0.56) ABCC2
SCHEMBL3403779 0.91 — —
SCHEMBL3402011 0.91 — —
SCHEMBL3399655 0.91 ABCC2 (0.61) ABCC2
SCHEMBL3402612 0.90 ABCC2 (0.61) ABCC2
SCHEMBL3404593 0.90 — —
SCHEMBL3405681 0.87 — —
SCHEMBL3405489 0.86 ABCC2 (0.58) ABCC2
SCHEMBL3407092 0.86 ABCC2 (0.66) ABCC2
SCHEMBL3405634 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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