SCHEMBL3406343

SCHEMBL3406343

CO[C@H]1CN(c2nc(-c3ncccc3F)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 0.60

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
SCHEMBL3405811 0.93 ABCC2 (0.55) ABCC2
SCHEMBL3406547 0.92 — —
SCHEMBL3397925 0.91 — —
SCHEMBL3404674 0.90 ABCC2 (0.65) ABCC2
SCHEMBL3404817 0.89 ABCC2 (0.62) ABCC2
SCHEMBL3402682 0.87 — —
SCHEMBL3434307 0.87 — —
SCHEMBL3407125 0.86 ABCC2 (0.66) ABCC2
SCHEMBL3405310 0.86 ABCC2 (0.64) ABCC2
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
Send feedback