SCHEMBL10544353

SCHEMBL10544353

O=[C]C(NC(=O)N1CCN(N=Cc2ccco2)C1=O)c1cccs1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.38
▸ L3MBTL1 Q9Y468 6/20 0.35
▸ MEN1 O00255 6/20 0.35
▸ HTT P42858 4/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ ALDH1A1 P00352 11/20 0.34
▸ SMN1; SMN2 Q16637 4/20 0.34
▸ POLB P06746 6/20 0.33
▸ MAPT P10636 5/20 0.33
▸ RAB9A P51151 4/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ BLM P54132 3/20 0.33
▸ RECQL P46063 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ CACNA1B Q00975 1/20 0.32
▸ APBA1 Q02410 1/20 0.32
▸ MCL1 Q07820 1/20 0.32

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
SCHEMBL9661414 0.86 MAPT (0.41) KMT2AL3MBTL1MEN1HTTALDH1A1
SCHEMBL9661405 0.86 MAPT (0.41) KMT2AL3MBTL1MEN1HTTALDH1A1
SCHEMBL9661357 0.84 ALDH1A1 (0.33) KMT2AL3MBTL1MEN1ALDH1A1SMN1; SMN2
SCHEMBL9661366 0.84 ALDH1A1 (0.33) KMT2AL3MBTL1MEN1ALDH1A1SMN1; SMN2
SCHEMBL10544858 0.84 POLB (0.36) L3MBTL1CYP2C19ALDH1A1SMN1; SMN2POLB
SCHEMBL10544836 0.82 LMNA (0.37) KMT2AL3MBTL1MEN1CYP2C9CYP2C19
SCHEMBL10544180 0.79 KMT2A (0.31) KMT2AL3MBTL1ALDH1A1POLB
SCHEMBL10681062 0.79 KMT2A (0.33) KMT2AALDH1A1SMN1; SMN2
SCHEMBL10543369 0.78 MEN1 (0.33) KMT2AL3MBTL1MEN1HTTALDH1A1
SCHEMBL11078892 0.78 KMT2A (0.31) KMT2AL3MBTL1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4822788-A MICROBIOCIDES, BETA-LACTAMASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-04-18 — — US disclosed
US-4822790-A ANTIMICROBIOCIDES OR BETA-LACTAMASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-04-18 — — US disclosed
US-4782147-A ANTIBIOTIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-11-01 — — US disclosed
US-4771045-A 2-oxozetidinone derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-09-13 — — US disclosed
US-4725591-A USED WITH AMINO ACID DERIVATIVE ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-02-16 — — US disclosed
EP-0095764-B1 2-OXOAZETIDINONE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1987-09-02 — — EP disclosed
US-4683303-A Reduction process for the preparation of 4-unsubstituted azetidin-2-ones PFAENDLER HANS R (DE) 1987-07-28 — — US disclosed
US-4675397-A MICROBIOCIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-06-23 — — US disclosed
US-4665067-A BACTERICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-05-12 — — US disclosed
EP-0083039-B1 4-CYANO-2-AZETIDINONES AND PRODUCTION THEREOF Takeda Chemical Industries, Ltd. (JP) 1986-03-19 — — EP disclosed
US-4550105-A BETA-LACTAMASE INHIBITORS, ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-10-29 — — US disclosed
EP-0053815-B1 2-OXOAZETIDINE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1985-05-08 — — EP disclosed
EP-0053387-A1 Method of preparing 1-sulfo-2-oxoazetidine derivatives and intermediates therefor Takeda Chemical Industries, Ltd. (JP) 1982-06-09 — — EP disclosed
EP-0050965-A1 Beta-lactamase inhibitory composition Takeda Chemical Industries, Ltd. (JP) 1982-05-05 — — EP disclosed
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