SCHEMBL10546806

SCHEMBL10546806

O=[C]C(NC(=O)N1CCN(CCO)C(=O)C1=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.34
▸ RAB9A P51151 1/20 0.33
▸ CTSS P25774 1/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ EPHX2 P34913 1/20 0.32
▸ CACNA2D1 P54289 1/20 0.32
▸ CACNA1B Q00975 1/20 0.32
▸ CACNB1 Q02641 1/20 0.32
▸ CACNA1C Q13936 1/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ RET P07949 1/20 0.31
▸ KDR P35968 1/20 0.31
▸ OPRK1 P41145 1/20 0.31

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
SCHEMBL10545517 0.89 ALDH1A1 (0.37) HTTALDH1A1RAB9ACTSSL3MBTL1
SCHEMBL8626971 0.87 POLB (0.38) HTTALDH1A1CTSSL3MBTL1KMT2A
SCHEMBL10541118 0.86 PKM (0.39) ALDH1A1KMT2AMEN1OPRK1
SCHEMBL10547320 0.85 PKM (0.41) ALDH1A1KMT2AMEN1OPRK1
SCHEMBL10545030 0.85 PKM (0.41) ALDH1A1KMT2AMEN1OPRK1
SCHEMBL8622094 0.79 MEN1 (0.38) HTTALDH1A1RAB9ACTSSEPHX2
SCHEMBL8082394 0.79 CHRM1 (0.36) HTTALDH1A1RAB9ACTSSEPHX2
SCHEMBL8625044 0.77 GPBAR1 (0.37) CTSSCACNA2D1CACNA1BCACNB1CACNA1C
SCHEMBL10546411 0.77 KMT2A (0.41) KMT2ANPC1MEN1
SCHEMBL10546517 0.76 HDAC1 (0.35) CTSSEPHX2KMT2AMEN1

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 17 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-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-4684724-A ANTIBIOTICS, BETA-LACTAMASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-08-04 — — 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-4560508-A BETA-LACTAMASE INHIBITORS, ANINICROBIAL AGENT, CHEMICAL INTERMEDIATE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-12-24 — — US 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-0095764-A2 2-Oxoazetidinone derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1983-12-07 — — EP disclosed
EP-0053815-A1 2-Oxoazetidine derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1982-06-16 — — 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
EP-0021676-A1 3-Methoxy-2-oxoazetidine derivatives and their production Takeda Chemical Industries, Ltd. (JP) 1981-01-07 — — EP disclosed
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