SCHEMBL13780809

SCHEMBL13780809

CC(=O)C[C@H](N)Cc1cc(F)c(F)cc1F

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.58
DPP7 Q9UHL4 2/20 0.53
CYP3A4 P08684 4/20 0.50
DPP8 Q6V1X1 2/20 0.49

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
SCHEMBL16750214 1.00 DPP4 (0.58) DPP4DPP7CYP3A4DPP8
SCHEMBL28257065 0.84 DPP4 (0.55) DPP4DPP7CYP3A4DPP8
SCHEMBL29441821 0.84 DPP4 (0.55) DPP4DPP7CYP3A4DPP8
SCHEMBL743047 0.84 DPP4 (0.55) DPP4DPP7CYP3A4DPP8
SCHEMBL572053 0.84 DPP4 (0.55) DPP4DPP7CYP3A4DPP8
SCHEMBL28665124 0.84 DPP4 (0.55) DPP4DPP7CYP3A4DPP8
SCHEMBL28257067 0.84 DPP4 (0.55) DPP4DPP7CYP3A4DPP8
SCHEMBL29441819 0.84 DPP4 (0.55) DPP4DPP7CYP3A4DPP8
SCHEMBL28181301 0.84 DPP4 (0.55) DPP4DPP7CYP3A4DPP8
SCHEMBL743022 0.84 DPP4 (0.55) DPP4DPP7CYP3A4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200332321-A1 ENGINEERED TRANSAMINASE POLYPEPTIDES AND USES THEREOF Enzymaster (Ningbo) Bio-Engineering Co., Ltd (CN) 2020-10-22 US disclosed
WO-2020200153-A1 GLUCOSIDE DERIVATIVE THAT ACTS AS SGLT1 INHIBITOR AND APPLICATION THEREOF 南京明德新药研发有限公司 2020-10-08 WO disclosed
WO-2020067930-A1 COMPOUNDS FOR TREATING TYPE 2 DIABETES Общество с ограниченной ответственностью "Необиотек" 2020-04-02 WO disclosed
US-20090192326-A1 Preparation of sitagliptin intermediate TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-07-30 US 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-20090192326-A1 Preparation of sitagliptin intermediate DPP4, DPP7, DPP3 DPP4 1/4885DPP7 2/4885CYP3A4 214/4885

“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.