SCHEMBL4574754

SCHEMBL4574754

CNC1CCN(c2nc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)C1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.61
CHRM2 P08172 2/20 0.58
DRD1 P21728 1/20 0.58
LMNA P02545 2/20 0.57
KDM4E B2RXH2 2/20 0.57
ABCC4 O15439 1/20 0.57
HSD17B10 Q99714 1/20 0.57
KMT2A Q03164 1/20 0.53
DHFR P00374 1/20 0.49
CYP2C9 P11712 1/20 0.49
ATP6V1B2 P21281 1/20 0.49
TBXA2R P21731 1/20 0.49
EDNRA P25101 1/20 0.49
TARBP2 Q15633 1/20 0.49
TOP1 P11387 1/20 0.49
ALDH1A1 P00352 2/20 0.47
POLB P06746 1/20 0.47
CHRM1 P11229 1/20 0.47
OPRM1 P35372 1/20 0.47
OPRD1 P41143 1/20 0.47

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
Hydrochloric Acid SCHEMBL10654741 0.99 DPP4 (0.60) DPP4CHRM2DRD1LMNAKDM4E
SCHEMBL9150328 0.93 DPP4 (0.67) DPP4CHRM2DRD1LMNAKDM4E
SCHEMBL10654645 0.91 DPP4 (0.58) DPP4CHRM2DRD1LMNAKDM4E
SCHEMBL10656681 0.89 DPP4 (0.56) DPP4CHRM2DRD1LMNAKDM4E
SCHEMBL7837172 0.88 DPP4 (0.57) DPP4CHRM2DRD1LMNAKDM4E
SCHEMBL7837178 0.88 DPP4 (0.57) DPP4CHRM2DRD1LMNAKDM4E
SCHEMBL9303242 0.88 DPP4 (0.57) DPP4CHRM2DRD1LMNAKDM4E
SCHEMBL10655952 0.87 DPP4 (0.50) DPP4CHRM2DRD1LMNAKDM4E
SCHEMBL9382133 0.87 DPP4 (0.58) DPP4CHRM2DRD1LMNAKDM4E
SCHEMBL10928412 0.87 DPP4 (0.64) DPP4CHRM2DRD1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4649144-A Antibacterial 7-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acid derivatives DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1987-03-10 US claimed
EP-0132845-A2 Novel 1,8-Naphthyridine derivatives, and process for preparation thereof Dainippon Pharmaceutical Co., Ltd. (JP) 1985-02-13 EP claimed
US-7320985-B2 Method for stabilizing arylcarboxylic acid, stabilizer thereof and aqueous solution containing stabilized arylcarboxylic acid SENJU PHARMACEUTICAL CO., LTD. (JP) 2008-01-22 US disclosed
EP-1389469-B1 Method for stabilizing arylcarboxylic acid, stabilizer thereof and aqueous solution containing stabilized arylcarboxylic acid SENJU PHARMA CO (JP) 2005-10-26 EP disclosed
US-20050075350-A1 Method for stabilizing arylcarboxylic acid, stabilizer thereof and aqueous solution containing stabilized arylcarboxylic acid SAWA SHIROU (JP) 2005-04-07 US disclosed
EP-1044688-B1 METHOD FOR SOLUBILIZING PYRIDONECARBOXYLIC ACIDS AND AQUEOUS SOLUTIONS CONTAINING PYRIDONECARBOXYLIC ACIDS SENJU PHARMA CO (JP) 2004-12-01 EP disclosed
EP-1389469-A1 Method for stabilizing arylcarboxylic acid, stabilizer thereof and aqueous solution containing stabilized arylcarboxylic acid Senju Pharmaceutical Co., Ltd. (JP) 2004-02-18 EP disclosed
EP-0856310-B1 Method for stabilizing arylcarboxylic acid, stabilizer thereof and aqueous solution containing stabilized arylcarboxylic acid SENJU PHARMA CO (JP) 2003-11-12 EP disclosed
US-20010056098-A1 Method for stabilizing arylcarboxylic acid, stabilizer thereof and aqueous solution containing stabilized arylcarboxylic acid SAWA SHIROU (JP) 2001-12-27 US disclosed
US-6306856-B1 DISSOLVING PYRIDONECARBOXYLIC ACID OR SALT, MIXING WITH GLYCYRRHIZIC ACID WITH ACID SENJU PHARMACEUTICAL CO., LTD. (JP) 2001-10-23 US disclosed
US-6274592-B1 ADDING FUSED NITROGEN-HETEROCYCLIC BASE SUCH AS PURINE DERIVATIVE SENJU PHARMACEUTICAL CO., LTD. (JP) 2001-08-14 US disclosed
EP-1044688-A1 METHOD FOR SOLUBILIZING PYRIDONECARBOXYLIC ACID, SOLUBILIZER THEREFOR, AQUEOUS SOLUTION PREPARATIONS CONTAINING PYRIDONECARBOXYLIC ACID AND PROCESS FOR PRODUCING THE SAME Senju Pharmaceutical Co., Ltd. (JP) 2000-10-18 EP disclosed
US-5942508-A Method for solubilizing pyridonecarboxylic acid solubilizer thereof and aqueous solution containing solubilized pyridonecarboxylic acid SENJU PHARMACEUTICAL CO., LTD. (JP) 1999-08-24 US disclosed
US-5858408-A Sustained-release oral ointment TOYAMA CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0856310-A2 Method for stabilizing acriylcarboxylic acid, stabilizer thereof and aqueous solution containing stabilized acrylcarboxylic acid Senju Pharmaceutical Co., Ltd. (JP) 1998-08-05 EP disclosed
EP-0856316-A1 Method for solubilizing pyridonecarboxylic acid, solubilizer thereof and aqueous solution containing solubilized pyridonecarboxylic acid Senju Pharmaceutical Co., Ltd. (JP) 1998-08-05 EP disclosed
EP-0788801-A1 SUSTAINED-RELEASE ORAL OINTMENT TOYAMA CHEMICAL CO., LTD. (JP) 1997-08-13 EP disclosed
EP-0132845-B1 NOVEL 1,8-NAPHTHYRIDINE DERIVATIVES, AND PROCESS FOR PREPARATION THEREOF Dainippon Pharmaceutical Co., Ltd. (JP) 1988-04-13 EP disclosed
US-4649144-A Antibacterial 7-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acid derivatives DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1987-03-10 US disclosed
EP-0132845-A2 Novel 1,8-Naphthyridine derivatives, and process for preparation thereof Dainippon Pharmaceutical Co., Ltd. (JP) 1985-02-13 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 (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-20050075350-A1 Method for stabilizing arylcarboxylic acid, stabilizer thereof and aqueous solution containing stabilized arylcarboxylic acid AADAC, AASDHPPT, ALDH7A1 DPP4 667/4885CHRM2 4821/4885DRD1 1669/4885
US-20010056098-A1 Method for stabilizing arylcarboxylic acid, stabilizer thereof and aqueous solution containing stabilized arylcarboxylic acid AADAC, AASDHPPT, ALDH7A1 DPP4 667/4885CHRM2 4821/4885DRD1 1669/4885

“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.