SCHEMBL2708404

SCHEMBL2708404

CC(C)(C)OC(=O)N1C[C@@H](NC(=O)c2ccccc2)C[C@H]1C(=O)N1CCSC1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.48
USP30 Q70CQ3 6/20 0.46
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
DPP4 P27487 3/20 0.42
NR1H2 P55055 1/20 0.41
PREP P48147 2/20 0.41
HSD17B10 Q99714 1/20 0.41
ANPEP P15144 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL2710308 0.88 DPP4 (0.57) MMP2DPP4PREP
SCHEMBL2709313 0.87 DPP4 (0.53) DPP4PREPHSD17B10
SCHEMBL2709311 0.87 DPP4 (0.53) DPP4PREPHSD17B10
SCHEMBL2712091 0.87 DPP4 (0.55) USP30DPP4NR1H2PREPHSD17B10
SCHEMBL2707643 0.85 MMP2 (0.59) MMP2USP30KDM4EPKMNR1H2
SCHEMBL2709145 0.85 MMP2 (0.59) MMP2USP30KDM4EPKMNR1H2
SCHEMBL4920687 0.84 KDM4E (0.56) USP30KDM4EPKMDPP4PREP
SCHEMBL2712190 0.84 DPP4 (0.55) DPP4PREPHSD17B10
SCHEMBL2712192 0.84 DPP4 (0.55) DPP4PREPHSD17B10
SCHEMBL2711088 0.83 SFRP1 (0.46) DPP4NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1930319-B1 Proline derivatives and use thereof as drugs MITSUBISHI TANABE PHARMA CORP (JP) 2012-05-02 EP disclosed
EP-1308439-B1 PROLINE DERIVATIVES AND USE THEREOF AS DRUGS MITSUBISHI TANABE PHARMA CORP (JP) 2008-10-15 EP disclosed
EP-1950199-A1 Proline derivatives and use thereof as drugs Mitsubishi Tanabe Pharma Corporation (JP) 2008-07-30 EP disclosed
EP-1930319-A1 Proline derivatives and use thereof as drugs Mitsubishi Tanabe Pharma Corporation (JP) 2008-06-11 EP disclosed
US-20060173056-A1 Proline derivatives and use thereof as drugs KITAJIMA HIROSHI 2006-08-03 US disclosed
US-7074794-B2 Proline derivatives and the use thereof as drugs MITSUBISHI PHARMA CORPORATION (JP) 2006-07-11 US disclosed
US-7060722-B2 Proline derivatives and use thereof as drugs MITSUBISHI PHARMA CORPORATION (JP) 2006-06-13 US disclosed
US-20050245538-A1 Proline derivatives and use thereof as drugs KITAJIMA HIROSHI 2005-11-03 US disclosed
US-20040106655-A1 Proline derivatives and the use thereof as drugs MITSUBISHI TANABE PHARMA CORPORATION (JP) 2004-06-03 US disclosed
EP-1308439-A1 PROLINE DERIVATIVES AND USE THEREOF AS DRUGS WELFIDE CORPORATION (JP) 2003-05-07 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-20060173056-A1 Proline derivatives and use thereof as drugs DPP4, DPP3, DPP7 MMP2 45/4885USP30 1808/4885KDM4E 455/4885
US-20050245538-A1 Proline derivatives and use thereof as drugs DPP4, DPP3, DPP7 MMP2 45/4885USP30 1808/4885KDM4E 455/4885
US-20040106655-A1 Proline derivatives and the use thereof as drugs DPP4, DPP3, DPP7 MMP2 42/4885USP30 1818/4885KDM4E 563/4885

“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.