SCHEMBL1345017

SCHEMBL1345017

CCOC(=O)c1c[nH]c2c(OC)c(F)c(F)cc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2C19 P33261 1/20 0.59
CLEC4M Q9H2X3 1/20 0.54
KDM4E B2RXH2 3/20 0.51
GABRA1 P14867 3/20 0.49
GABRB2 P47870 3/20 0.49
GABRB1 P18505 2/20 0.48
GABRA3 P34903 2/20 0.48
MAPT P10636 2/20 0.47
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
STAT3 P40763 1/20 0.43
ALDH1A1 P00352 2/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL29376920 0.89 CYP1A2 (0.66) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E
SCHEMBL9635290 0.89 CYP1A2 (0.66) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E
SCHEMBL20258340 0.88 CYP1A2 (0.42) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E
SCHEMBL19971590 0.85 CYP1A2 (0.62) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E
SCHEMBL30540821 0.85 CYP1A2 (0.62) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E
SCHEMBL14845077 0.85 CYP1A2 (0.58) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E
SCHEMBL4723533 0.85 CYP1A2 (0.53) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E
SCHEMBL29145962 0.84 CLEC4M (0.62) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E
SCHEMBL30697790 0.84 CLEC4M (0.62) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E
SCHEMBL11235716 0.84 CYP1A2 (0.63) CYP1A2CYP3A4CYP2C19CLEC4MKDM4E

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
CN-108088930-B Detection method of quinoline carboxylic acid ethyl ester or/and related substances thereof 成都百裕制药股份有限公司 2021-02-26 CN disclosed
EP-2013182-B1 AMINOQUINOLONES AS GSK-3 INHIBITORS KYORIN SEIYAKU KK (JP) 2013-09-04 EP disclosed
EP-2013182-B1 AMINOQUINOLONES AS GSK-3 INHIBITORS KYORIN SEIYAKU KK (JP) 2013-09-04 EP disclosed
EP-2383271-B1 Aminoquinolones as GSK-3 Inhibitors KYORIN SEIYAKU KK (JP) 2013-07-10 EP disclosed
US-8063221-B2 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
US-8063221-B2 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
US-8063221-B2 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
EP-2383271-A1 Aminoquinolones as GSK-3 Inhibitors Kyorin Pharmaceutical Co., Ltd. (JP) 2011-11-02 EP disclosed
EP-2383271-A1 Aminoquinolones as GSK-3 Inhibitors Kyorin Pharmaceutical Co., Ltd. (JP) 2011-11-02 EP disclosed
EP-2013182-A2 AMINOQUINOLONES AS GSK-3 INHIBITORS Activx Biosciences, Inc. (US) 2009-01-14 EP disclosed
US-20070254866-A1 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
US-20070254866-A1 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
US-20070254866-A1 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
WO-2007106537-A2 AMINOQUINOLONES AS GSK-3 INHIBITORS ACTIVX BIOSCIENCES, INC. (US) 2007-09-20 WO 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-20070254866-A1 Aminoquinolones as GSK-3 inhibitors GSK3B, GSK3A, GSKIP CYP1A2 1836/4885CYP3A4 2064/4885CYP2C19 3526/4885

“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.