SCHEMBL26210945

SCHEMBL26210945

COC(=O)[C@@H]1CCCCN1C(=O)[C@H](N)Cc1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.58
DPP7 Q9UHL4 10/20 0.58
DPP8 Q6V1X1 8/20 0.58
DPP9 Q86TI2 8/20 0.58
FAP Q12884 7/20 0.58
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
PEPD P12955 1/20 0.45

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
Trifluoroacetic Acid SCHEMBL30574548 0.94 DPP4 (0.53) DPP4DPP7DPP8DPP9FAP
SCHEMBL26210944 0.88 ALDH1A1 (0.47) DPP4DPP7DPP8DPP9FAP
SCHEMBL6779815 0.86 DPP4 (0.63) DPP4DPP7DPP8DPP9FAP
SCHEMBL28202772 0.85 DPP4 (0.62) DPP4DPP7DPP8DPP9FAP
SCHEMBL12658450 0.85 DPP4 (0.62) DPP4DPP7DPP8DPP9FAP
SCHEMBL28202773 0.85 DPP4 (0.62) DPP4DPP7DPP8DPP9FAP
SCHEMBL6341798 0.85 DPP4 (0.49) DPP4DPP7DPP8DPP9FAP
SCHEMBL25383266 0.84 DPP4 (0.53) DPP4DPP7DPP8DPP9FAP
SCHEMBL30661440 0.83 DPP4 (0.68) DPP4DPP7DPP8DPP9FAP
SCHEMBL22901867 0.83 DPP4 (0.51) DPP4DPP7DPP8DPP9FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230278996-A1 YKL-40 INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS MOLECURE S.A. (PL) 2023-09-07 US disclosed
US-20230278996-A1 YKL-40 INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS MOLECURE S.A. (PL) 2023-09-07 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-20230278996-A1 YKL-40 INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS CHI3L1, CHI3L2, CHIA DPP4 570/4885DPP7 369/4885DPP8 278/4885

“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.