SCHEMBL2844967

SCHEMBL2844967

CCOC(=O)c1cn(C2CC2)c2c(F)c(F)c(F)cc2c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.68
STAT3 P40763 2/20 0.57
TOP2A P11388 6/20 0.54
TOP2B Q02880 6/20 0.54
KCNH2 Q12809 2/20 0.49
KMT2A Q03164 1/20 0.48
HTT P42858 1/20 0.47
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45

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
SCHEMBL29492858 1.00 ADRB2 (0.68) ADRB2STAT3TOP2ATOP2BKCNH2
SCHEMBL143605 0.93 ADRB2 (0.64) ADRB2STAT3TOP2ATOP2BKCNH2
SCHEMBL10627001 0.93 ADRB2 (0.66) ADRB2STAT3TOP2ATOP2BKCNH2
SCHEMBL9693055 0.92 ADRB2 (0.65) ADRB2STAT3TOP2ATOP2BKCNH2
SCHEMBL115991 0.92 ADRB2 (0.62) ADRB2STAT3TOP2ATOP2BKCNH2
SCHEMBL7599453 0.92 ADRB2 (0.65) ADRB2STAT3TOP2ATOP2BKCNH2
SCHEMBL7575069 0.91 ADRB2 (0.61) ADRB2STAT3TOP2ATOP2BKCNH2
SCHEMBL9188190 0.91 ADRB2 (0.61) ADRB2STAT3TOP2ATOP2BKCNH2
SCHEMBL5704396 0.91 ADRB2 (0.64) ADRB2STAT3TOP2ATOP2BKCNH2
SCHEMBL8735574 0.90 ADRB2 (0.61) ADRB2STAT3TOP2ATOP2BKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112641773-A Composition containing heterocyclic compound and use thereof 黄泳华 2021-04-13 CN claimed
CN-111150734-A Compositions containing mixtures of quinolinone derivatives and uses thereof 黄泳华 2020-05-15 CN claimed
US-4952695-A Cyclopropyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-3-quinoline carboxylic acid, intermediate for antibacterials BAYER AKTIENGESELLSCHAFT (DE) 1990-08-28 US claimed
JP-60222462-A None JP disclosed
JP-60178867-A None JP disclosed
CN-111989314-B Method for hydrolyzing quinolone formate 拜耳动物保健有限责任公司 2024-04-30 CN disclosed
EP-3784656-B1 PROCESS FOR THE HYDROLYSIS OF QUINOLONE CARBOXYLIC ESTERS ELANCO ANIMAL HEALTH GMBH (DE) 2023-06-28 EP disclosed
US-11332444-B2 Method for the hydrolysis of quinolonecarboxylic esters BAYER ANIMAL HEALTH GMBH (DE) 2022-05-17 US disclosed
CN-112641773-A Composition containing heterocyclic compound and use thereof 黄泳华 2021-04-13 CN disclosed
US-20210078950-A1 METHOD FOR THE HYDROLYSIS OF QUINOLONECARBOXYLIC ESTERS ELANCO ANIMAL HEALTH GMBH (DE) 2021-03-18 US disclosed
CN-111989314-A Process for hydrolysis of quinolone formates 拜耳动物保健有限责任公司 2020-11-24 CN disclosed
EP-0198678-A2 A process for preparing substituted quinoline-3-carboxylic acids WARNER-LAMBERT COMPANY (US) 1986-10-22 EP disclosed
US-4599334-A 7-(3-aryl-1-piperazinyl)- and 7-(3-cyclohexyl-1-piperazinyl)-3-quinolonecarboxylic acid antibacterials BAYER AKTIENGESELLSCHAFT (DE) 1986-07-08 US disclosed
EP-0183129-A1 Quinolonecarboxylic acid derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 1986-06-04 EP disclosed
US-4588726-A 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(3-oxo-1-piperazinyl)-3-quinolinecarboxylic acid antibacterial agents BAYER AKTIENGESELLSCHAFT (DE) 1986-05-13 US disclosed
EP-0178388-A1 Quinolinecarboxylic acid derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 1986-04-23 EP disclosed
US-4578473-A Process for quinoline-3-carboxylic acid antibacterial agents WARNER-LAMBERT COMPANY (US) 1986-03-25 US disclosed
US-4556658-A 7-Amino-1-cyclopropyl-6,8-difluoro-1,4-dihydro-4-oxo-quinoline-3-carboxylic acids and antibacterial agents containing these compounds BAYER AKTIENGESELLSCHAFT (DE) 1985-12-03 US disclosed
JP-S60222462-A QUINOLONE CARBOXYLIC ACID AND ITS PRODUCTION KYORIN PHARMACEUT CO LTD 1985-11-07 JP disclosed
JP-S60178867-A DIHALOGENOQUINOLINE DERIVATIVE DAI ICHI SEIYAKU CO LTD 1985-09-12 JP 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 (2 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-20210078950-A1 METHOD FOR THE HYDROLYSIS OF QUINOLONECARBOXYLIC ESTERS NQO2, PGD, ALAD ADRB2 2182/4885STAT3 4531/4885TOP2A 38/4885
US-11332444-B2 Method for the hydrolysis of quinolonecarboxylic esters NQO2, PGD, ALAD ADRB2 2182/4885STAT3 4531/4885TOP2A 38/4885

“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.