SCHEMBL9039878

SCHEMBL9039878

CC(O)[C@H]1C(=O)N2C(C(=O)OCc3ccc([N+](=O)[O-])cc3)C(=O)[C@H](C)[C@H]12

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.48
HTR2A P28223 1/20 0.43
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
ATM Q13315 1/20 0.40
HTT P42858 1/20 0.39
MAOB P27338 1/20 0.38

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
SCHEMBL10768544 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10675931 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL14875217 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL2062622 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL18036888 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10767245 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL6893609 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10758551 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10670342 0.91 HTR2A (0.43) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10676045 0.91 HTR2A (0.43) ELANEHTR2AALDH1A1MAPTHPGD

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
EP-0442497-B1 Novel beta-lactam compounds and their production SUMITOMO PHARMA (JP) 1996-08-14 EP disclosed
EP-0658162-A1 CARBAPENEM DERIVATIVES AND PROCESSES FOR PREPARING THE SAME DONG-A PHARM. CO., LTD. (KR) 1995-06-21 EP disclosed
EP-0126587-B1 Carboxylic thio-pyrrolidinyl beta-lactam compounds and production thereof SUMITOMO PHARMA (JP) 1995-04-19 EP disclosed
WO-1994005667-A1 CARBAPENEM DERIVATIVES AND PROCESSES FOR PREPARING THE SAME DONG-A PHARMACEUTICAL CO., LTD. (KR) 1994-03-17 WO disclosed
US-5227376-A Quaternary ammonium carbapenem antibiotics SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 1993-07-13 US disclosed
US-5122604-A 2-(2-Carbonyl-substituted pyrrolidin-4-yl)carbapenems and -penems; microbiocides SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 1992-06-16 US disclosed
EP-0442497-A1 Novel beta-lactam compounds and their production SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1991-08-21 EP disclosed
US-4962103-A MICROBIOCIDES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1990-10-09 US disclosed
EP-0182213-B1 CARBAPENEM COMPOUNDS AND PRODUCTION THEREOF SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1990-09-26 EP disclosed
US-4943569-A B-lactam compounds SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 1990-07-24 US disclosed
US-4933333-A β-lactam compounds SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 1990-06-12 US disclosed
EP-0188816-A1 Novel beta-lactams and their production SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1986-07-30 EP disclosed
EP-0182213-A1 Carbapenem compounds and production thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1986-05-28 EP disclosed
EP-0126587-A1 Carboxylic thio-pyrrolidinyl beta-lactam compounds and production thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1984-11-28 EP disclosed