SCHEMBL17080490

SCHEMBL17080490

CC(CCN)(C(=O)O)S(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.36
MMP12 P39900 1/20 0.36
MMP13 P45452 1/20 0.36

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
SCHEMBL17260435 1.00 SLC6A2 (0.36) SLC6A2MMP12MMP13
Hydrochloric Acid SCHEMBL18953979 0.98 SLC6A2 (0.36) SLC6A2MMP12MMP13
SCHEMBL2022509 0.80 SLC6A2 (0.34) SLC6A2MMP12MMP13
SCHEMBL12100629 0.80 SLC6A2 (0.34) SLC6A2MMP12MMP13
SCHEMBL28512295 0.77 CYP4F2 (0.35) SLC6A2MMP12MMP13
SCHEMBL17818233 0.77 CYP4F2 (0.35) SLC6A2MMP12MMP13
SCHEMBL16569687 0.76 DGAT1 (0.39) SLC6A2MMP12MMP13
SCHEMBL20025578 0.76 SLC6A2 (0.33) SLC6A2MMP12MMP13
SCHEMBL16569689 0.76 DGAT1 (0.39) SLC6A2MMP12MMP13
SCHEMBL17818301 0.75 ACLY (0.37) SLC6A2MMP12MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019038362-A1 ANTIBACTERIAL PYRROLOIMIDAZOLONES IDORSIA PHARMACEUTICALS LTD (CH) 2019-02-28 WO disclosed
CN-106061977-B 1, 2-dihydro-3H-pyrrolo [1,2-C ] imidazol-3-one derivatives and their use as antibacterial agents 爱杜西亚药品有限公司 2018-10-26 CN disclosed
EP-3143007-B1 ANTIBACTERIAL QUINAZOLINE-4(3H)-ONE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2018-07-11 EP disclosed
EP-3334737-A1 SUBSTITUTED 1,2-DIHYDRO-3H Idorsia Pharmaceuticals Ltd (CH) 2018-06-20 EP disclosed
CN-108137596-A 1,2- dihydro -3H- pyrrolo-es [1,2-c] imidazoles -3- ketone antimicrobial compounds being substituted 爱杜西亚药品有限公司 2018-06-08 CN disclosed
CN-107922433-A Antibacterial Cyclic Pyrrolidin-2-one Derivatives 爱杜西亚药品有限公司 2018-04-17 CN disclosed
US-9796686-B2 Antibacterial quinazoline-4(3H)-one derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2017-10-24 US disclosed
US-20170081292-A1 ANTIBACTERIAL QUINAZOLINE-4(3H)-ONE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2017-03-23 US disclosed
EP-3143007-A1 ANTIBACTERIAL QUINAZOLINE-4(3H)-ONE DERIVATIVES Actelion Pharmaceuticals Ltd (CH) 2017-03-22 EP disclosed
CN-106458931-A Antibacterial quinazolin-4 (3H) -one derivatives 埃科特莱茵药品有限公司 2017-02-22 CN disclosed
WO-2017025562-A1 SUBSTITUTED 1,2-DIHYDRO-3H PYRROLO[1,2-c]IMIDAZOL-3 ONE ANTIBACTERIALS ACTELION PHARMACEUTICALS LTD (CH) 2017-02-16 WO disclosed
EP-3114126-A1 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS Actelion Pharmaceuticals Ltd (CH) 2017-01-11 EP disclosed
CN-106061977-A 1, 2-dihydro-3H-pyrrolo [1,2-C ] imidazol-3-one derivatives and their use as antibacterial agents 埃科特莱茵药品有限公司 2016-10-26 CN disclosed
WO-2015173329-A1 ANTIBACTERIAL QUINAZOLINE-4(3H)-ONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2015-11-19 WO disclosed
WO-2015132228-A1 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS ACTELION PHARMACEUTICALS LTD (CH) 2015-09-11 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-20170081292-A1 ANTIBACTERIAL QUINAZOLINE-4(3H)-ONE DERIVATIVES MRPL21, PYM1, MDK SLC6A2 3724/4885MMP12 2980/4885MMP13 4206/4885

“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.