SCHEMBL10077057

SCHEMBL10077057

CC(C)(CNC(=O)CC(N)Cc1cc(F)ccc1F)CNC(=O)C(O)C(N)COCc1ccc(-c2cccnc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.36
DPP4 P27487 15/20 0.36
DPP7 Q9UHL4 9/20 0.35
DPP9 Q86TI2 7/20 0.35
DPP8 Q6V1X1 10/20 0.35
SMPD1 P17405 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
SCHEMBL10078066 0.92 REN (0.37) RENDPP4DPP7DPP9DPP8
SCHEMBL10078067 0.92 DPP4 (0.41) RENDPP4DPP7DPP9DPP8
SCHEMBL6873029 0.92 DPP4 (0.38) RENDPP4DPP7DPP9DPP8
SCHEMBL10074326 0.87 DPP4 (0.41) RENDPP4DPP7DPP9DPP8
SCHEMBL10074457 0.87 DPP4 (0.41) RENDPP4DPP7DPP9DPP8
SCHEMBL10075001 0.85 REN (0.42) RENDPP4DPP7DPP9DPP8
SCHEMBL10074280 0.85 REN (0.42) RENDPP4DPP7DPP9DPP8
SCHEMBL6873594 0.84 DPP4 (0.39) RENDPP4DPP7DPP9DPP8
SCHEMBL6872762 0.83 LAP3 (0.40) RENDPP4DPP7DPP9DPP8
SCHEMBL10074281 0.80 DPP4 (0.41) RENDPP4DPP7DPP9DPP8

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-20120028995-A1 NOVEL COMPOUNDS FOR MEDICAL USE AS PEPTIDASE EFFECTORS IMTM GMBH (DE) 2012-02-02 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-20120028995-A1 NOVEL COMPOUNDS FOR MEDICAL USE AS PEPTIDASE EFFECTORS SERPINB1, CMA1, CPA3 REN 449/4885DPP4 121/4885DPP7 86/4885

“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.