SCHEMBL3401114

SCHEMBL3401114

Cc1cnc(-c2nc(N3CC[C@@H](NC(=O)c4[nH]c(C)c(Cl)c4Cl)[C@@H](F)C3)sc2OC(=O)O)cn1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ABCC2 Q92887 1/20 0.52

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
SCHEMBL3407092 0.90 ABCC2 (0.66) ABCC2
SCHEMBL3400987 0.89 — —
SCHEMBL3400614 0.88 — —
SCHEMBL3407101 0.88 — —
SCHEMBL3402503 0.88 — —
SCHEMBL3405372 0.88 — —
SCHEMBL3406340 0.87 — —
SCHEMBL3402341 0.87 — —
SCHEMBL3400993 0.87 — —
SCHEMBL13993275 0.86 — —

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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