SCHEMBL11801124

SCHEMBL11801124

C=CC(O)N1C(=O)c2cccc3cccc(c23)C1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ERCC1 P07992 1/20 0.53
▸ FEN1 P39748 1/20 0.53
▸ ERCC4 Q92889 1/20 0.53
▸ ALDH1A1 P00352 9/20 0.50
▸ KDM4E B2RXH2 7/20 0.50
▸ HPGD P15428 4/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ HSD17B10 Q99714 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ CASP1 P29466 2/20 0.47
▸ CASP7 P55210 2/20 0.47
▸ GAA P10253 1/20 0.47
▸ HEXA P06865 3/20 0.46
▸ HEXB P07686 3/20 0.46
▸ LMNA P02545 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ CYP1A2 P05177 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ AKR1B1 P15121 1/20 0.45
▸ ALOX15 P16050 1/20 0.45

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
SCHEMBL9064462 0.84 TDP1 (0.49) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL15485548 0.80 ERCC1 (0.49) ERCC1FEN1ERCC4ALDH1A1KDM4E
SCHEMBL4438479 0.77 ALDH1A1 (0.61) ERCC1FEN1ERCC4ALDH1A1KDM4E
SCHEMBL12386897 0.75 CYP1B1 (0.59) ERCC1FEN1ERCC4ALDH1A1KDM4E
SCHEMBL4195640 0.73 CYP1B1 (0.57) ERCC1FEN1ERCC4ALDH1A1KDM4E
SCHEMBL28150387 0.73 ERCC1 (0.42) ERCC1FEN1ERCC4ALDH1A1KDM4E
SCHEMBL1506415 0.73 CYP1B1 (0.49) ERCC1FEN1ERCC4ALDH1A1KDM4E
SCHEMBL2639668 0.73 ERCC1 (0.57) ERCC1FEN1ERCC4ALDH1A1KDM4E
SCHEMBL10299247 0.73 KDM4E (0.57) ERCC1FEN1ERCC4ALDH1A1KDM4E
SCHEMBL29279659 0.73 ERCC1 (0.57) ERCC1FEN1ERCC4ALDH1A1KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4006238-A Use of 2-(hydroxyalkyl)-1H-benz[de]isoquinoline-1,3(2H)-diones as anti-allergy agents E. R. SQUIBB & SONS, INC. (US) 1977-02-01 — — US disclosed
US-4006238-A Use of 2-(hydroxyalkyl)-1H-benz[de]isoquinoline-1,3(2H)-diones as anti-allergy agents E. R. SQUIBB & SONS, INC. (US) 1977-02-01 — — US disclosed
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