SCHEMBL29319358

SCHEMBL29319358

CC(C)C(=O)COc1ccc2nccc(C(=O)NCC(=O)N3CC(F)(F)C[C@H]3C#N)c2c1

nearest known ligand 0.81

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP9 Q86TI2 8/20 0.81
DPP4 P27487 8/20 0.81
PREP P48147 3/20 0.81
FAP Q12884 7/20 0.77
DPP8 Q6V1X1 2/20 0.76
PITRM1 Q5JRX3 1/20 0.69

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
SCHEMBL23567893 0.91 DPP9 (0.86) DPP9DPP4PREPFAPDPP8
SCHEMBL15130011 0.90 DPP9 (1.00) DPP9DPP4PREPFAPDPP8
SCHEMBL15130010 0.90 DPP9 (1.00) DPP9DPP4PREPFAPDPP8
SCHEMBL29286011 0.89 DPP9 (0.84) DPP9DPP4PREPFAPDPP8
SCHEMBL30338169 0.89 DPP9 (0.84) DPP9DPP4PREPFAPDPP8
SCHEMBL24729425 0.88 DPP9 (0.79) DPP9DPP4PREPFAPDPP8
SCHEMBL27347166 0.88 DPP9 (0.81) DPP9DPP4PREPFAPDPP8
SCHEMBL24729026 0.88 DPP9 (0.81) DPP9DPP4PREPFAPDPP8
SCHEMBL25518164 0.88 FAP (0.74) DPP9DPP4PREPFAPDPP8
SCHEMBL23733190 0.87 DPP9 (0.75) DPP9DPP4PREPFAPDPP8

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-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF PURDUE RESEARCH FOUNDATION 2024-07-18 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-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF FAP, FIBP, FGFR1 DPP9 263/4885DPP4 385/4885PREP 281/4885

“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.