SCHEMBL4254601

SCHEMBL4254601

Cc1ccc2sc3nc(C=C4C(=O)N5C(C(=O)O)=CS[C@H]45)cn3c2c1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 1/20 0.38
PARP10 Q53GL7 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
PARP2 Q9UGN5 1/20 0.38

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
SCHEMBL4254598 0.93 PARP15 (0.38) PARP15PARP10TNKS2PARP2
SCHEMBL4254592 0.93 PARP15 (0.38) PARP15PARP10TNKS2PARP2
SCHEMBL4267705 0.89
SCHEMBL4267686 0.88 PARP15 (0.41) PARP15PARP10TNKS2PARP2
SCHEMBL2932072 0.87
SCHEMBL2932070 0.87
SCHEMBL4257282 0.83 PARP15 (0.38) PARP15TNKS2PARP2
SCHEMBL4257117 0.83 MAPT (0.46) PARP15PARP10TNKS2PARP2
SCHEMBL4267680 0.83 MAPT (0.46) PARP15PARP10TNKS2PARP2
SCHEMBL4259817 0.81 PARP15 (0.38) PARP15PARP10TNKS2PARP2

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-1499622-B1 HETEROTRICYCLYL 6-ALKYLIDENE-PENEMS AS BETA-LACTAMASE INHIBITORS WYETH CORP (US) 2009-03-11 EP claimed