SCHEMBL13285547

SCHEMBL13285547

C=C(C)OC(=O)NC(C(=O)N1CC(O)CC1C(=O)NC(CC)C(=O)N1CCCC1B(O)O)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 14/20 0.40
▸ PREP P48147 6/20 0.40
▸ DPP4 P27487 15/20 0.38
▸ DPP7 Q9UHL4 12/20 0.38
▸ DPP8 Q6V1X1 9/20 0.38
▸ DPP9 Q86TI2 8/20 0.38
▸ VHL P40337 1/20 0.36
▸ PITRM1 Q5JRX3 1/20 0.34

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
SCHEMBL13259712 0.88 FAP (0.39) FAPPREPDPP4DPP7DPP8
SCHEMBL13382231 0.83 DPP4 (0.58) FAPPREPDPP4DPP7DPP8
SCHEMBL13285545 0.78 PREP (0.43) PREP
SCHEMBL13285546 0.77 ATM (0.47) DPP4VHL
SCHEMBL13285548 0.76 ALDH1A1 (0.53) DPP4
SCHEMBL15386487 0.72 DPP4 (0.65) FAPPREPDPP4DPP7DPP8
SCHEMBL12658501 0.72 DPP4 (0.65) FAPPREPDPP4DPP7DPP8
SCHEMBL13399328 0.72 DPP4 (0.65) FAPPREPDPP4DPP7DPP8
SCHEMBL13285822 0.71 DPP4 (0.64) FAPPREPDPP4DPP7DPP8
SCHEMBL13399704 0.70 ACE (0.43) DPP4

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-20100168032-A1 Smart Pro-Drugs of Serine Protease Inhibitors TRUSTEES OF TUFTS COLLEGE (US) 2010-07-01 — — 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-20100168032-A1 Smart Pro-Drugs of Serine Protease Inhibitors FAP, PREP, CTSC FAP 1/4885PREP 2/4885DPP4 8/4885

“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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