SCHEMBL29960205

SCHEMBL29960205

O=C(c1ccccc1)c1cccc2c(=O)n(O)c(=O)[nH]c12

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FEN1 P39748 20/20 0.59
▸ ERCC1 P07992 2/20 0.52
▸ ERCC4 Q92889 2/20 0.52
▸ ERCC5 P28715 3/20 0.50
▸ CA12 O43570 1/20 0.50
▸ RNASEH1 O60930 1/20 0.50
▸ CA9 Q16790 1/20 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
SCHEMBL29960006 0.77 FEN1 (0.62) FEN1ERCC1ERCC4ERCC5CA12
SCHEMBL29959996 0.76 FEN1 (0.67) FEN1
SCHEMBL29960340 0.75 FEN1 (1.00) FEN1ERCC1ERCC4ERCC5CA12
SCHEMBL18670294 0.74 FEN1 (1.00) FEN1ERCC1ERCC4ERCC5CA12
SCHEMBL31485136 0.74 PBRM1 (0.58) —
SCHEMBL3910030 0.74 PBRM1 (0.58) —
SCHEMBL18670508 0.72 FEN1 (1.00) FEN1ERCC1ERCC4ERCC5CA12
SCHEMBL29959783 0.71 FEN1 (0.63) FEN1ERCC1ERCC4ERCC5CA12
SCHEMBL717723 0.70 AKR1C3 (0.64) —
SCHEMBL13752239 0.70 PIK3CG (0.65) —

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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