SCHEMBL9329467

SCHEMBL9329467

NC(CCOc1ccc(/C([C]=O)=N/O)cc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.43
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
LTA4H P09960 5/20 0.40
PARP10 Q53GL7 1/20 0.39
PKM P14618 1/20 0.38
GAA P10253 2/20 0.38
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HTT P42858 1/20 0.37
GRM8 O00222 1/20 0.37
GRM6 O15303 1/20 0.37
GRM4 Q14833 1/20 0.37
RARB P10826 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL8311458 1.00 MAPK1 (0.43) MAPK1ITGB3ITGA2BLTA4HPARP10
SCHEMBL10856941 0.85 KMT2A (0.42)
SCHEMBL10856947 0.85 KMT2A (0.42)
SCHEMBL8126091 0.82 LTA4H (0.38) LTA4HALDH1A1HSD17B10HTTGRM8
SCHEMBL9329038 0.82 LTA4H (0.38) LTA4HALDH1A1HSD17B10HTTGRM8
SCHEMBL11268633 0.81 MAPK1 (0.46) MAPK1ITGB3ITGA2BLTA4HPARP10
SCHEMBL11457731 0.81 MAPK1 (0.46) MAPK1ITGB3ITGA2BLTA4HPARP10
SCHEMBL11105281 0.80 ITGB3 (0.46) MAPK1ITGB3ITGA2BGAAALDH1A1
SCHEMBL11105286 0.80 ITGB3 (0.46) MAPK1ITGB3ITGA2BGAAALDH1A1
SCHEMBL10332953 0.80 GAA (0.47) MAPK1ITGB3ITGA2BLTA4HPARP10

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0225634-B1 Antibacterial compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-04-06 EP disclosed
EP-0251330-B1 Cephalosporin derivatives, process for their preparation and pharmaceutical compositions containing them HOFFMANN LA ROCHE (CH) 1993-12-01 EP disclosed
US-5189157-A ANTIBACTERIAL CEPHALOSPORIN COMPOUNDS HOFFMANN LA ROCHE INC. (US) 1993-02-23 US disclosed
US-5147871-A Anti-bacterial cephalosporin compounds HOFFMANN LA-ROCHE, INC. (US) 1992-09-15 US disclosed
EP-0160252-B1 Antibacterial compounds Takeda Chemical Industries, Ltd. (JP) 1992-08-26 EP disclosed
US-5066800-A For coupling cephalosporins to quinolines(or derivatives) HOFFMANN-LA ROCHE INC. (US) 1991-11-19 US disclosed
EP-0453952-A2 A process for synthesizing cephalosporin compounds F. HOFFMANN-LA ROCHE AG (CH) 1991-10-30 EP disclosed
US-4946837-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-08-07 US disclosed
EP-0164113-B1 3-PYRAZOLO(1,5-A)PYRIDINIUM CEPHEM COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1990-05-16 EP disclosed
EP-0322810-A2 Cephalosporin derivatives F. HOFFMANN-LA ROCHE AG (CH) 1989-07-05 EP disclosed
US-4788185-A Cephalosporin compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-11-29 US disclosed
EP-0251330-A2 Cephalosporin derivatives, process for their preparation and pharmaceutical compositions containing them F. HOFFMANN-LA ROCHE AG (CH) 1988-01-07 EP disclosed
EP-0229369-A2 Cephalosporins, process for their preparation and pharmaceutical compositions containing them Takeda Chemical Industries, Ltd. (JP) 1987-07-22 EP disclosed
EP-0225634-A2 Antibacterial compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1987-06-16 EP disclosed
US-4665065-A 3-pyrazolo(1,5-aαpyridinium cephem compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-05-12 US disclosed
EP-0216385-A2 Antibacterial compounds Takeda Chemical Industries, Ltd. (JP) 1987-04-01 EP disclosed
EP-0206000-A1 (2,3)-Alpha-methylenepenam-3-carboxylic acids and derivatives thereof F. HOFFMANN-LA ROCHE AG (CH) 1986-12-30 EP disclosed
EP-0164113-A2 3-pyrazolo(1,5-a)pyridinium cephem compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1985-12-11 EP disclosed
EP-0164122-A2 Cephem compounds Takeda Chemical Industries, Ltd. (JP) 1985-12-11 EP disclosed
EP-0160252-A2 Antibacterial compounds Takeda Chemical Industries, Ltd. (JP) 1985-11-06 EP disclosed