SCHEMBL14187258

SCHEMBL14187258

N[C@@H](CC(=O)N1CCn2c(nnc2-c2ccccc2)C1)Cc1ccccc1F

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 20/20 0.77
▸ DPP8 Q6V1X1 14/20 0.77
▸ DPP9 Q86TI2 2/20 0.60
▸ DPP7 Q9UHL4 2/20 0.59
▸ ACE P12821 1/20 0.59
▸ HTR2A P28223 1/20 0.59
▸ FAP Q12884 1/20 0.59

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
SCHEMBL2667448 0.89 DPP4 (0.75) DPP4DPP8DPP9DPP7ACE
SCHEMBL14187434 0.85 DPP4 (0.73) DPP4DPP8DPP9DPP7ACE
SCHEMBL2667530 0.85 DPP4 (0.77) DPP4DPP8DPP9DPP7ACE
SCHEMBL8364024 0.84 DPP4 (0.66) DPP4DPP8DPP9DPP7ACE
SCHEMBL8364721 0.80 DPP4 (0.76) DPP4DPP8DPP9DPP7
SCHEMBL13593626 0.80 DPP4 (0.76) DPP4DPP8DPP9DPP7
SCHEMBL3845270 0.79 DPP4 (0.89) DPP4DPP8DPP9DPP7ACE
SCHEMBL8363512 0.79 DPP4 (0.64) DPP4DPP8DPP9DPP7ACE
SCHEMBL8362641 0.78 DPP4 (0.60) DPP4DPP8DPP9DPP7
SCHEMBL8362642 0.78 DPP4 (0.62) DPP4DPP8DPP9DPP7

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-20080125403-A1 Method of Treating Men with Metabolic and Anthropometric Disorders MERCK & CO., INC. (US) 2008-05-29 — — US disclosed
US-20080125403-A1 Method of Treating Men with Metabolic and Anthropometric Disorders MERCK & CO., INC. (US) 2008-05-29 — — 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-20080125403-A1 Method of Treating Men with Metabolic and Anthropometric Disorders CYP17A1, SHBG, CYP21A2 DPP4 158/4885DPP8 378/4885DPP9 176/4885

“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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