SCHEMBL17180404

SCHEMBL17180404

CC(C)(C)OC(=O)N1CC(F)(F)CC1C#N

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.50
FAP Q12884 10/20 0.38
PREP P48147 10/20 0.38
CTSK P43235 1/20 0.37
DPP9 Q86TI2 2/20 0.36
DPP8 Q6V1X1 2/20 0.36
PITRM1 Q5JRX3 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
SCHEMBL21105170 1.00 DPP4 (0.50) DPP4FAPPREPCTSKDPP9
SCHEMBL17180405 1.00 DPP4 (0.50) DPP4FAPPREPCTSKDPP9
SCHEMBL2124054 0.86 CTSK (0.41) DPP4CTSKDPP9DPP8
SCHEMBL26782713 0.85 HSD17B10 (0.36) DPP4CTSK
SCHEMBL5373165 0.81 DPP4 (0.40) DPP4FAPPREPDPP9DPP8
SCHEMBL23760630 0.80 DPP4 (0.52) DPP4FAPPREPCTSKDPP9
SCHEMBL21105037 0.80 DPP4 (0.52) DPP4FAPPREPCTSKDPP9
SCHEMBL22169492 0.80 DPP4 (0.52) DPP4FAPPREPCTSKDPP9
SCHEMBL15130380 0.79 PREP (0.52) DPP4FAPPREPDPP9DPP8
SCHEMBL15130381 0.79 PREP (0.52) DPP4FAPPREPDPP9DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025133915-A1 COMPOUNDS WHICH BIND TO PNPLA3I148M AND THEIR USE TO TREAT LIVER DISEASES NOVARTIS AG (CH) 2025-06-26 WO disclosed
CN-115160204-B Fibroblast activation protein inhibitor and preparation method and application thereof 山东大学 2024-04-09 CN disclosed
CN-116583303-A Tripterine conjugates and uses thereof 瑞阳公司 2023-08-11 CN disclosed
CN-111991570-B FAP-alpha specific tumor diagnosis SPECT imaging agent 北京大学 2021-05-18 CN disclosed
CN-111991570-A FAP-alpha specific tumor diagnosis SPECT imaging agent 北京大学 2020-11-27 CN disclosed
US-10112956-B2 Heterocyclic compounds having cholesterol 24-hydroxylase activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-10-30 US disclosed
EP-2933247-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2018-08-29 EP disclosed
US-20170197983-A1 HETEROCYCLIC COMPOUNDS HAVING CHOLESTEROL 24-HYDROXYLASE ACTIVITY TAKEDA PHARMACEUTICALS CO (JP) 2017-07-13 US disclosed
US-9643957-B2 Heterocyclic compounds having cholesterol 24-hydroxylase activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-05-09 US disclosed
US-20150315209-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-11-05 US disclosed
EP-2933247-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2015-10-21 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-10112956-B2 Heterocyclic compounds having cholesterol 24-hydroxylase activity CYP46A1, CYP27A1, NCEH1 DPP4 603/4885FAP 1202/4885PREP 832/4885
US-20170197983-A1 HETEROCYCLIC COMPOUNDS HAVING CHOLESTEROL 24-HYDROXYLASE ACTIVITY CYP46A1, CYP27A1, NCEH1 DPP4 603/4885FAP 1202/4885PREP 832/4885
US-20150315209-A1 HETEROCYCLIC COMPOUND HCN4, KCNH1, SCN4A DPP4 431/4885FAP 2087/4885PREP 1768/4885

“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.