SCHEMBL5785348

SCHEMBL5785348

CCOC(=O)C(=CCl)C(=O)OCC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.58
GLO1 Q04760 1/20 0.58
ALDH1A1 P00352 4/20 0.50
CYP2D6 P10635 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
LMNA P02545 4/20 0.44
MAPT P10636 4/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
S1PR4 O95977 1/20 0.44
S1PR1 P21453 1/20 0.44
MAPK1 P28482 1/20 0.44
DHODH Q02127 2/20 0.43
HSD17B10 Q99714 1/20 0.42
GAA P10253 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
PLIN1 O60240 1/20 0.41

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
SCHEMBL13934145 0.82 NPSR1 (0.46) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL13934148 0.80 GLO1 (0.48) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL15273109 0.79 GLO1 (0.77) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL1942274 0.79 NPSR1 (0.62) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL13269051 0.79 NPSR1 (0.62) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL4852525 0.78 ALDH1A1 (0.53) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL15094234 0.78 NPSR1 (0.56) NPSR1GLO1ALDH1A1CYP2D6SMN1; SMN2
SCHEMBL3192124 0.78
SCHEMBL13973671 0.78
SCHEMBL3192121 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115850297-A Synthetic method of sarin antibiotic drug intermediate 常州兰陵制药有限公司 2023-03-28 CN claimed
CN-115819339-A Synthesis method of 6, 7-difluoro-8-hydroxy-4-oxo-1, 4-dihydroquinoline-3-carboxylic acid 常州兰陵制药有限公司 2023-03-21 CN claimed
CN-115772176-A Synthetic method of key drug intermediate of levofloxacin 常州兰陵制药有限公司 2023-03-10 CN claimed
CN-115403521-A Synthesis method of lomefloxacin hydrochloride intermediate 常州兰陵制药有限公司 2022-11-29 CN claimed
CN-115819339-A Synthesis method of 6, 7-difluoro-8-hydroxy-4-oxo-1, 4-dihydroquinoline-3-carboxylic acid 常州兰陵制药有限公司 2023-03-21 CN disclosed
CN-115772176-A Synthetic method of key drug intermediate of levofloxacin 常州兰陵制药有限公司 2023-03-10 CN disclosed
CN-115772176-A Synthetic method of key drug intermediate of levofloxacin 常州兰陵制药有限公司 2023-03-10 CN disclosed
CN-115490606-A Method for preparing medical intermediate from 2-chloromethylene-diethyl malonate 安徽泽升科技有限公司 2022-12-20 CN disclosed
CN-115403521-A Synthesis method of lomefloxacin hydrochloride intermediate 常州兰陵制药有限公司 2022-11-29 CN disclosed
CN-115403521-A Synthesis method of lomefloxacin hydrochloride intermediate 常州兰陵制药有限公司 2022-11-29 CN disclosed
EP-1270577-B1 FUROISOQUINOLINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2006-12-06 EP disclosed
US-6924292-B2 Furoisoquinoline derivatives, process for producing the same and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-02 US disclosed
US-20040092582-A1 Furoisoquinoline derivatives, process for producing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-05-13 US disclosed
EP-1270577-A1 FUROISOQUINOLINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-01-02 EP disclosed
EP-0376870-A1 A new organosilylpolyphosphoric reagent, its preparation and application to the process of synthesis of 3-carboxyquinolones or azaquinolones and their salts CENTRO MARGA PARA LA INVESTIGACION S.A. (ES) 1990-07-04 EP disclosed
EP-0168025-B1 PROCESS FOR PRODUCING AMINOTHIAZOLYLPROPENDICARBOXYLIC ACID MONOESTERS SHIONOGI & CO., LTD. (JP) 1989-09-27 EP disclosed
US-4652652-A PENICILLIN OR CEPHALOSPORIN INTERMEDIATE SHIONOGI & CO., LTD. (JP) 1987-03-24 US disclosed
EP-0168025-A1 Process for producing aminothiazolylpropendicarboxylic acid monoesters SHIONOGI & CO., LTD. (JP) 1986-01-15 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040092582-A1 Furoisoquinoline derivatives, process for producing the same and use thereof PDE3B, PDE5A, PDE3A NPSR1 3231/4885GLO1 1389/4885ALDH1A1 572/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.