SCHEMBL11269818

SCHEMBL11269818

COC(=O)C(=O)CC(=O)c1cccc(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 2/20 0.50
EGLN2 Q96KS0 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA6 P23280 1/20 0.47
CA9 Q16790 1/20 0.47
ERCC5 P28715 4/20 0.47
FEN1 P39748 4/20 0.47
KMT2A Q03164 2/20 0.46
PARP1 P09874 1/20 0.46
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
RAB9A P51151 1/20 0.46
PTPN1 P18031 1/20 0.44
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.44
P4HB P07237 1/20 0.43
MEN1 O00255 1/20 0.42

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
SCHEMBL2263377 0.83 CTNNB1 (0.54) KDM4EALDH1A1ERCC5FEN1KMT2A
SCHEMBL7671012 0.83 KDM4E (0.53) KDM4EALDH1A1EGLN2CA12CA1
SCHEMBL29819613 0.82 KMT2A (0.61) KDM4EALDH1A1ERCC5FEN1KMT2A
SCHEMBL20239513 0.82 KMT2A (0.61) KDM4EALDH1A1ERCC5FEN1KMT2A
SCHEMBL20487359 0.82 KDM4E (0.54) KDM4EALDH1A1ERCC5FEN1KMT2A
SCHEMBL8231217 0.82 ERCC5 (0.69) KDM4EALDH1A1ERCC5FEN1KMT2A
SCHEMBL2200555 0.82 L3MBTL1 (0.50) KDM4EALDH1A1ERCC5FEN1KMT2A
SCHEMBL5482399 0.82 ERCC5 (0.46) KDM4EALDH1A1ERCC5FEN1KMT2A
SCHEMBL5898776 0.81 FEN1 (0.67) KDM4EALDH1A1EGLN2CA12CA1
SCHEMBL1109662 0.80 ERCC5 (0.64) KDM4EALDH1A1ERCC5FEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3589630-B1 CYCLIC SULFAMIDE COMPOUNDS AND METHODS OF USING SAME ASSEMBLY BIOSCIENCES INC (US) 2021-07-07 EP disclosed
US-4315932-A AND SULFANILAMIDES BURROUGHS WELLCOME CO. (US) 1982-02-16 US disclosed
EP-0000541-B1 1H-PYRIMIDO-(4,5-C)-1,2-DIAZEPINES, METHODS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM; THEIR USE AS INTERMEDIATES FOR HETEROCYCLIC TRANSFORMATIONS. THE WELLCOME FOUNDATION LIMITED (GB) 1982-02-03 EP disclosed
US-4288365-A 1H-PYRIMIDO(4,5-C)-1,2-DIAZEPINES BURROUGHS WELLCOME CO. (US) 1981-09-08 US disclosed
US-4260758-A MICROBIOCIDES BURROUGHS WELLCOME CO. (US) 1981-04-07 US disclosed
US-4237289-A MICROBIOCIDES BURROUGHS WELLCOME CO. (US) 1980-12-02 US disclosed
EP-0000541-A2 1H-Pyrimido-(4,5-c)-1,2-diazepines, methods for their preparation and compositions containing them; their use as intermediates for heterocyclic transformations. THE WELLCOME FOUNDATION LIMITED (GB) 1979-02-07 EP disclosed