SCHEMBL9952887

SCHEMBL9952887

NC(=O)c1cncc(OCBr)c1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 20/20 0.50
SIRT3 Q9NTG7 18/20 0.50
SIRT1 Q96EB6 16/20 0.50

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
SCHEMBL9448534 0.83 PARP10 (0.56) SIRT2SIRT3SIRT1
SCHEMBL9448404 0.81 SIRT2 (0.49) SIRT2SIRT3SIRT1
SCHEMBL9448549 0.80 SIRT2 (0.48) SIRT2SIRT3SIRT1
SCHEMBL30433345 0.80 SIRT2 (0.50) SIRT2SIRT3SIRT1
SCHEMBL9448322 0.80 SIRT2 (0.48) SIRT2SIRT3SIRT1
SCHEMBL30434557 0.80 SIRT2 (0.50) SIRT2SIRT3SIRT1
SCHEMBL9448533 0.80 SIRT2 (0.48) SIRT2SIRT3SIRT1
SCHEMBL15314416 0.80 SIRT2 (0.57) SIRT2SIRT3SIRT1
SCHEMBL9448446 0.79 SIRT2 (0.47) SIRT2SIRT3SIRT1
SCHEMBL30281289 0.79 SIRT2 (0.47) SIRT2SIRT3SIRT1

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
WO-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed