SCHEMBL18084196

SCHEMBL18084196

C[C@H](NCl)C(=O)N1CCC[C@H]1B(O)O

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 13/20 0.71
▸ PREP P48147 8/20 0.71
▸ DPP4 P27487 16/20 0.65
▸ DPP7 Q9UHL4 14/20 0.65
▸ DPP8 Q6V1X1 12/20 0.65
▸ DPP9 Q86TI2 11/20 0.65
▸ PITRM1 Q5JRX3 1/20 0.61

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
SCHEMBL13347225 0.86 FAP (0.73) FAPPREPDPP4DPP7DPP8
SCHEMBL8286524 0.86 FAP (0.73) FAPPREPDPP4DPP7DPP8
SCHEMBL8249904 0.83 FAP (1.00) FAPPREPDPP4DPP7DPP8
SCHEMBL8243719 0.83 FAP (1.00) FAPPREPDPP4DPP7DPP8
SCHEMBL8286526 0.82 DPP4 (0.73) FAPPREPDPP4DPP7DPP8
SCHEMBL15334846 0.81 DPP4 (0.65) FAPPREPDPP4DPP7DPP8
SCHEMBL8286523 0.79 DPP4 (1.00) FAPPREPDPP4DPP7DPP8
Hydrochloric Acid SCHEMBL31758343 0.78 DPP4 (0.97) FAPPREPDPP4DPP7DPP8
SCHEMBL25890374 0.77 DPP4 (0.72) FAPPREPDPP4DPP7DPP8
SCHEMBL21746362 0.77 DPP4 (0.74) FAPPREPDPP4DPP7DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160250237-A1 SOFT PROTEASE INHIBITORS AND PRO-SOFT FORMS THEREOF BACH BIOSCIENCES, LLC 2016-09-01 — — 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-20160250237-A1 SOFT PROTEASE INHIBITORS AND PRO-SOFT FORMS THEREOF PREP, DPP4, PEPD FAP 51/4885PREP 1/4885DPP4 2/4885

“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.

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