SCHEMBL3403907

SCHEMBL3403907

CCOC(=O)Oc1sc(N2CC[C@@H](NC(=O)c3[nH]c(C)c(Cl)c3Cl)[C@@H](OC)C2)nc1-c1cnccn1

nearest known ligand 0.76

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
SCHEMBL3402357 0.93 ABCC2 (0.64) ABCC2
SCHEMBL3403419 0.92 ABCC2 (0.60) ABCC2
SCHEMBL3404843 0.91 ABCC2 (0.47) ABCC2
SCHEMBL3404663 0.91 — —
SCHEMBL3407012 0.90 ABCC2 (0.56) ABCC2
SCHEMBL3405637 0.89 — —
SCHEMBL3405653 0.89 ABCC2 (0.59) ABCC2
SCHEMBL3401131 0.89 — —
SCHEMBL3405603 0.88 ABCC2 (0.56) ABCC2
SCHEMBL3400926 0.87 — —

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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