SCHEMBL21746978

SCHEMBL21746978

NC(=O)C[C@H](N)C(=O)N1Cc2ccc(F)cc2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP9 Q86TI2 12/20 1.00
DPP8 Q6V1X1 14/20 0.74
DPP7 Q9UHL4 8/20 0.64
DPP4 P27487 7/20 0.64
PITRM1 Q5JRX3 1/20 0.56
FAP Q12884 1/20 0.51
HDAC8 Q9BY41 1/20 0.47

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
SCHEMBL21746928 0.85 DPP8 (1.00) DPP9DPP8DPP7DPP4PITRM1
SCHEMBL21746987 0.81 DPP9 (1.00) DPP9DPP8DPP7DPP4PITRM1
SCHEMBL21746934 0.78 DPP9 (1.00) DPP9DPP8DPP7DPP4PITRM1
SCHEMBL21746935 0.78 DPP9 (1.00) DPP9DPP8DPP7DPP4PITRM1
SCHEMBL30142417 0.78 DPP9 (0.63) DPP9DPP8DPP7DPP4PITRM1
SCHEMBL21156689 0.77 DPP9 (1.00) DPP9DPP8DPP7DPP4PITRM1
SCHEMBL21746415 0.77 DPP9 (1.00) DPP9DPP8DPP7DPP4PITRM1
SCHEMBL24958752 0.77 DPP9 (1.00) DPP9DPP8DPP7DPP4
SCHEMBL4772360 0.76 DPP9 (0.61) DPP9DPP8DPP7DPP4PITRM1
SCHEMBL4772362 0.76 DPP9 (0.61) DPP9DPP8DPP7DPP4PITRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230372372-A1 COMBINATION THERAPIES USING CASPASE-1 DEPENDENT ANTICANCER AGENTS AND PGE2 ANTAGONISTS TRUSTEES OF TUFTS COLLEGE 2023-11-23 US disclosed
US-20230372372-A1 COMBINATION THERAPIES USING CASPASE-1 DEPENDENT ANTICANCER AGENTS AND PGE2 ANTAGONISTS TRUSTEES OF TUFTS COLLEGE 2023-11-23 US disclosed
US-11559537-B2 Combination therapies using caspase-1 dependent anticancer agents and PGE2 antagonists TRUSTEES OF TUFTS COLLEGE (US) 2023-01-24 US disclosed
US-20200054655-A1 COMBINATION THERAPIES USING CASPASE-1 DEPENDENT ANTICANCER AGENTS AND PGE2 ANTAGONISTS TRUSTEES OF TUFTS COLLEGE 2020-02-20 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 (3 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-11559537-B2 Combination therapies using caspase-1 dependent anticancer agents and PGE2 antagonists CASP1, CASP2, APAF1 DPP9 1286/4885DPP8 904/4885DPP7 910/4885
US-20230372372-A1 COMBINATION THERAPIES USING CASPASE-1 DEPENDENT ANTICANCER AGENTS AND PGE2 ANTAGONISTS CASP1, CASP2, APAF1 DPP9 1286/4885DPP8 904/4885DPP7 910/4885
US-20200054655-A1 COMBINATION THERAPIES USING CASPASE-1 DEPENDENT ANTICANCER AGENTS AND PGE2 ANTAGONISTS CASP1, CASP2, APAF1 DPP9 1286/4885DPP8 904/4885DPP7 910/4885

“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.