SCHEMBL8313658

SCHEMBL8313658

CC(C)(C)OC(=O)/C(=N\O)c1csc(N)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
USP2 O75604 1/20 0.39
ESR1 P03372 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ABCC4 O15439 1/20 0.35
CNR1 P21554 1/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
NR1I2 O75469 1/20 0.33
PGR P06401 1/20 0.33
PTGS2 P35354 1/20 0.33
GABRA5 P31644 1/20 0.33

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
SCHEMBL8313661 1.00 MAPT (0.44) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL7079213 0.86 MAPT (0.43) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL7079216 0.86 MAPT (0.43) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL10546325 0.84 MAPT (0.48) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL10546339 0.84 MAPT (0.48) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL9659527 0.80 MEN1 (0.62) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL95686 0.80 MEN1 (0.62) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL95685 0.80 MEN1 (0.62) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL9652999 0.79 ESR1 (0.46) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL9652984 0.79 ESR1 (0.46) MAPTMEN1ALDH1A1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0093376-B2 1-Sulfo-2-azetidinone derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-04-07 EP disclosed
US-4948898-A MICROBIOCIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 1990-08-14 US disclosed
EP-0093376-B1 1-SULFO-2-AZETIDINONE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1990-03-21 EP disclosed
US-4699986-A AZETIDINE INTERMEDIATES FOR ISOCEPHALOSPORINS HOFMANN-LA ROCHE INC. (US) 1987-10-13 US disclosed
US-4673739-A BETA-LACTAMASE INHIBITOR, MICROBIOCIDE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-06-16 US disclosed
US-4652651-A Process for the manufacture of 1-sulpho-2-oxoazetidine carboxylic acid intermediates via catalytic ester cleavage HOFFMANN-LA ROCHE INC. (US) 1987-03-24 US disclosed
US-4617150-A MICROBIOCIDES HOFFMANN-LA ROCHE INC. (US) 1986-10-14 US disclosed
US-4576751-A ANTIBIOTICS HOFFMAN-LA ROCHE INC. (US) 1986-03-18 US disclosed
US-4572801-A LACTAMASE ENZYME INHIBITORS, MICROBIOCIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-02-25 US disclosed
EP-0093376-A2 1-Sulfo-2-azetidinone derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1983-11-09 EP disclosed