SCHEMBL10544141

SCHEMBL10544141

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

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 6/20 0.37
▸ TDP1 Q9NUW8 5/20 0.37
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ CRHBP P24387 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37
▸ ALDH1A1 P00352 5/20 0.36
▸ MAPT P10636 3/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ CTDSP1 Q9GZU7 2/20 0.34
▸ AHR P35869 1/20 0.34
▸ PLA2G7 Q13093 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ GAA P10253 1/20 0.34

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
SCHEMBL10544127 1.00 POLB (0.37) POLBTDP1L3MBTL1CRHBPCRHR2
SCHEMBL10544137 1.00 POLB (0.37) POLBTDP1L3MBTL1CRHBPCRHR2
SCHEMBL10811590 0.87 ALDH1A1 (0.36) POLBTDP1L3MBTL1CRHBPCRHR2
SCHEMBL10544858 0.86 POLB (0.36) POLBTDP1L3MBTL1CRHBPCRHR2
SCHEMBL10683037 0.85 MAPT (0.44) POLBTDP1L3MBTL1ALDH1A1MAPT
SCHEMBL10663407 0.85 MAPT (0.44) POLBTDP1L3MBTL1ALDH1A1MAPT
SCHEMBL11455918 0.85 MAPT (0.44) POLBTDP1L3MBTL1ALDH1A1MAPT
SCHEMBL10683033 0.85 MAPT (0.44) POLBTDP1L3MBTL1ALDH1A1MAPT
SCHEMBL9661414 0.82 MAPT (0.41) POLBTDP1L3MBTL1CRHBPCRHR2
SCHEMBL9661405 0.82 MAPT (0.41) POLBTDP1L3MBTL1CRHBPCRHR2

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 8 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
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
US-4550105-A BETA-LACTAMASE INHIBITORS, ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-10-29 — — US disclosed
EP-0050965-A1 Beta-lactamase inhibitory composition Takeda Chemical Industries, Ltd. (JP) 1982-05-05 — — EP disclosed
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