SCHEMBL2711568

SCHEMBL2711568

CC(C)(C)OC(=O)N1C[C@@H](N2CCC(c3nc4cc(C(F)(F)F)ccc4s3)CC2)C[C@H]1C(=O)N1CCSC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.40
PREP P48147 1/20 0.36
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
ABL1 P00519 2/20 0.34
BCR P11274 2/20 0.34
EIF2AK4 Q9P2K8 1/20 0.33
LMNA P02545 1/20 0.33
MCL1 Q07820 1/20 0.33
UBE2M P61081 2/20 0.33
DCUN1D1 Q96GG9 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
DYRK1A Q13627 1/20 0.33
USP2 O75604 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL2708613 0.88 DPP4 (0.44) DPP4LMNAUBE2MDCUN1D1
SCHEMBL2711239 0.85 DPP4 (0.40) DPP4PREPDPP8DPP9ABL1
SCHEMBL2849722 0.83 USP2 (0.51) DPP4PREPL3MBTL1USP2PKM
SCHEMBL2854679 0.83 DPP4 (0.43) DPP4PREPDPP8DPP9LMNA
SCHEMBL2709994 0.82 DPP4 (0.46) DPP4DPP8DPP9LMNAL3MBTL1
SCHEMBL2708669 0.82 DPP4 (0.47) DPP4PREPDPP8DPP9EIF2AK4
SCHEMBL2711201 0.80 ALDH1A1 (0.43) DPP4PREPL3MBTL1
SCHEMBL2709714 0.79 DPP4 (0.66) DPP4PREPDPP8DPP9EIF2AK4
SCHEMBL2708990 0.79 DPP4 (0.61) DPP4DPP8DPP9
SCHEMBL2712759 0.79 DPP4 (0.40) DPP4PREP

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 DPP4 1/4885PREP 7/4885DPP8 6/4885
US-20050245538-A1 Proline derivatives and use thereof as drugs DPP4, DPP3, DPP7 DPP4 1/4885PREP 7/4885DPP8 6/4885
US-20040106655-A1 Proline derivatives and the use thereof as drugs DPP4, DPP3, DPP7 DPP4 1/4885PREP 8/4885DPP8 6/4885

“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.