SCHEMBL21746926

SCHEMBL21746926

NCCCC[C@H](N)C(=O)N1Cc2ccccc2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 15/20 1.00
DPP8 Q6V1X1 10/20 1.00
DPP9 Q86TI2 9/20 1.00
HDAC8 Q9BY41 4/20 0.60
DPP4 P27487 2/20 0.51

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
SCHEMBL31653974 1.00 DPP7 (1.00) DPP7DPP8DPP9HDAC8DPP4
SCHEMBL28997417 1.00 DPP7 (1.00) DPP7DPP8DPP9HDAC8DPP4
SCHEMBL21746987 0.84 DPP9 (1.00) DPP7DPP8DPP9DPP4
SCHEMBL4775626 0.80 DPP8 (0.67) DPP7DPP8DPP9HDAC8DPP4
SCHEMBL4775624 0.80 DPP8 (0.67) DPP7DPP8DPP9HDAC8DPP4
SCHEMBL20570474 0.79 HDAC8 (0.69) DPP7DPP8DPP9HDAC8DPP4
SCHEMBL27431494 0.78 DPP8 (0.63) DPP7DPP8DPP9
SCHEMBL27726212 0.78 DPP8 (0.63) DPP7DPP8DPP9
SCHEMBL4773106 0.78 DPP8 (0.63) DPP7DPP8DPP9HDAC8DPP4
SCHEMBL4773123 0.78 DPP8 (0.63) DPP7DPP8DPP9HDAC8DPP4

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 5 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
CN-108136025-B A novel method of treating cancer using immunomodulation 比奥克斯塞尔医疗股份有限公司 2022-09-06 CN 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 DPP7 910/4885DPP8 904/4885DPP9 1286/4885
US-20230372372-A1 COMBINATION THERAPIES USING CASPASE-1 DEPENDENT ANTICANCER AGENTS AND PGE2 ANTAGONISTS CASP1, CASP2, APAF1 DPP7 910/4885DPP8 904/4885DPP9 1286/4885
US-20200054655-A1 COMBINATION THERAPIES USING CASPASE-1 DEPENDENT ANTICANCER AGENTS AND PGE2 ANTAGONISTS CASP1, CASP2, APAF1 DPP7 910/4885DPP8 904/4885DPP9 1286/4885

“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.