SCHEMBL29959806

SCHEMBL29959806

O=c1[nH]c2cccc(Br)c2c(=O)n1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FEN1 P39748 10/20 1.00
▸ ERCC5 P28715 3/20 0.66
▸ CA12 O43570 5/20 0.54
▸ CA9 Q16790 5/20 0.54
▸ RNASEH1 O60930 1/20 0.54
▸ ERCC1 P07992 1/20 0.54
▸ ERCC4 Q92889 1/20 0.54
▸ DAO P14920 4/20 0.49
▸ CNOT7 Q9UIV1 1/20 0.41

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
SCHEMBL18670453 1.00 FEN1 (1.00) FEN1ERCC5CA12CA9RNASEH1
SCHEMBL29960854 0.79 FEN1 (1.00) FEN1ERCC5CA12CA9RNASEH1
SCHEMBL9523839 0.79 FEN1 (0.66) FEN1ERCC5DAO
SCHEMBL18687484 0.79 FEN1 (1.00) FEN1ERCC5CA12CA9RNASEH1
SCHEMBL18670448 0.79 FEN1 (1.00) FEN1ERCC5CA12CA9RNASEH1
SCHEMBL1520708 0.71 FEN1 (1.00) FEN1ERCC5CA12CA9RNASEH1
SCHEMBL29933774 0.71 FEN1 (1.00) FEN1ERCC5CA12CA9RNASEH1
SCHEMBL6008314 0.70 FEN1 (0.52) FEN1CA12CA9
SCHEMBL30439700 0.70 FEN1 (0.52) FEN1CA12CA9
SCHEMBL27128377 0.68 ALOX5 (0.52) FEN1

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
CN-108430978-B 3-hydroxy-quinazoline-2, 4-dione derivatives and their use as nuclease modulators 路德维格癌症研究所有限责任公司 2022-11-22 — — CN disclosed
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