SCHEMBL500723

SCHEMBL500723

Cc1c(F)c(F)c(N)c2c(=O)c(C(=O)O)cn(C3CC3)c12

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 16/20 0.66
TOP2A P11388 2/20 0.66
TOP2B Q02880 2/20 0.66
CACNA1F O60840 1/20 0.64
POLB P06746 1/20 0.64
MAPK1 P28482 1/20 0.64
CACNA1D Q01668 1/20 0.64
KCNH2 Q12809 1/20 0.64
CACNA1S Q13698 1/20 0.64
CACNA1C Q13936 1/20 0.64
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL12673590 0.90 GSK3B (0.69) GSK3BTOP2ATOP2BCACNA1FPOLB
SCHEMBL9089522 0.90 GSK3B (0.63) GSK3BTOP2ATOP2BCACNA1FPOLB
SCHEMBL8111016 0.90 TOP2A (0.58) GSK3BTOP2ATOP2BCACNA1FPOLB
SCHEMBL9689537 0.90 GSK3B (0.68) GSK3BTOP2ATOP2BCACNA1FPOLB
SCHEMBL1345769 0.89 GSK3B (0.70) GSK3BTOP2ATOP2BCACNA1FPOLB
SCHEMBL14143619 0.89 GSK3B (0.61) GSK3BTOP2ATOP2BCACNA1FPOLB
SCHEMBL13581380 0.88 GSK3B (0.60) GSK3BTOP2ATOP2BCACNA1FPOLB
SCHEMBL9688213 0.86 GSK3B (0.64) GSK3BTOP2ATOP2BCACNA1FPOLB
SCHEMBL5236368 0.86 GSK3B (0.50) GSK3BTOP2ATOP2BCACNA1FPOLB
SCHEMBL501142 0.86 GSK3B (0.50) GSK3BTOP2ATOP2BCACNA1FPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1666477-B1 7-(4-SUBSTITUTED 3- CYCLOPROPYLAMINOMETHYL-1- PYRROLIDINYL) Q UINOLONECARBOXYLIC ACID DERIVATIVE KYORIN SEIYAKU KK (JP) 2013-07-03 EP disclosed
US-8106072-B2 7- (4-substituted-3-cyclopropylaminomethyl-1-pyrrolidinyl) quinolonecarboxylic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2012-01-31 US disclosed
US-20090176824-A1 7- (4-substituted-3-cyclopropylaminomethyl-1-pyrrolidinyl) quinolonecarboxylic acid derivative technical field ASAHINA YOSHIKAZU 2009-07-09 US disclosed
US-7514451-B2 7-(4-Substituted-3-cyclopropylaminomethyl-1 pyrrolidinyl) quinolonecarboxylic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2009-04-07 US disclosed
US-20060281779-A1 7-(4-Substituted-3-cyclopropylaminomethyl-1 pyrrolidinyl) quinolonecarboxylic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2006-12-14 US disclosed
EP-1666477-A1 7-(4-SUBSTITUTED 3- CYCLOPROPYLAMINOMETHYL-1- PYRROLIDINYL) Q UINOLONECARBOXYLIC ACID DERIVATIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2006-06-07 EP disclosed
EP-0911328-B1 SUBSTITUTED AMINOCYCLOALKYLPYRROLIDINE DERIVATIVES DAIICHI SEIYAKU CO (JP) 2006-02-08 EP disclosed
US-6825353-B2 AN AMINE SUBSTITUENT AT THE 7-POSITION OF THE QUINOLONE-CARBOXYLIC ACID DERIVATIVE IS PRODUCED; BACTERICIDES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-11-30 US disclosed
EP-1304329-A2 Pyridonecarboxylic acid derivatives and their use as antibacterial agents DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-04-23 EP disclosed
US-20030060631-A1 Process for producing quinolonecarboxlic acids and intermediates thereof DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-03-27 US disclosed
US-6184388-B1 ANTIBACTERIAL AND ANTIMICROBIAL, QUINOLINE ANTIBIOTIC DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-02-06 US disclosed
US-6121285-A 5-AMINO-7-(4-(1-AMINOCYCLOPROPYL-3-FLUORO-1-PYRROLIDINYL)-6 -FLUORO-1-(2-FLUORO-1-CYCLOPROPYL)-1,4-DIHYDRO-8-METHOXY-4-OXOQUINOLINE-3 -CARBOXYLIC ACID, FOR EXAMPLE; ANTIMICROBIAL DRUGS WITH HIGH SAFETY DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-09-19 US disclosed
EP-0911328-A1 SUBSTITUTED AMINOCYCLOALKYLPYRROLIDINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-04-28 EP disclosed
US-5859026-A ADMINISTERING AS AN ANTIBACTERIAL AGENT HOKURIKU SEIYAKU CO., LTD. (JP) 1999-01-12 US disclosed
US-5849757-A Pyridonecarboxylic acid derivatives substituted by a bicyclic amino group as antibacterials DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1998-12-15 US disclosed
EP-0807630-A1 HETEROCYCLIC COMPOUNDS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-11-19 EP disclosed
EP-0806421-A1 QUINOLINECARBOXYLIC ACID DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 1997-11-12 EP disclosed
EP-0641793-B1 5-Amino-8-methyl-7-pyrrolidinylquinoline-3-carboxylic acid derivative HOKURIKU PHARMACEUTICAL (JP) 1996-10-23 EP disclosed
US-5547962-A QUINOLONE ANTIBIOTICS HORURIKU SEIYAKU CO., LTD. (JP) 1996-08-20 US disclosed
EP-0641793-A1 5-Amino-8-methyl-7-pyrrolidinylquinoline-3-carboxylic acid derivative HOKURIKU SEIYAKU CO., LTD. (JP) 1995-03-08 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 (3 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-20090176824-A1 7- (4-substituted-3-cyclopropylaminomethyl-1-pyrrolidinyl) quinolonecarboxylic acid derivative technical field CLPP, PRSS1, FOSB GSK3B 4103/4885TOP2A 138/4885TOP2B 219/4885
US-20060281779-A1 7-(4-Substituted-3-cyclopropylaminomethyl-1 pyrrolidinyl) quinolonecarboxylic acid derivative RPS27L, RPS7, RPSA GSK3B 4399/4885TOP2A 171/4885TOP2B 308/4885
US-20030060631-A1 Process for producing quinolonecarboxlic acids and intermediates thereof NQO2, QPCT, QARS1 GSK3B 1080/4885TOP2A 747/4885TOP2B 785/4885

“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.