SCHEMBL23211381

SCHEMBL23211381

Cc1ccc(CC(N)C(=O)N2CC(C#N)C2)cc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 17/20 0.61
DPP8 Q6V1X1 12/20 0.61
DPP9 Q86TI2 12/20 0.61
DPP7 Q9UHL4 11/20 0.61
FAP Q12884 11/20 0.61
HCRTR2 O43614 3/20 0.53

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
SCHEMBL21411220 1.00 DPP4 (0.61) DPP4DPP8DPP9DPP7FAP
SCHEMBL22255191 0.83 DPP4 (0.53) DPP4DPP8DPP9DPP7FAP
SCHEMBL21410996 0.81 S1PR1 (0.51) DPP4DPP8DPP9DPP7FAP
SCHEMBL23211355 0.81 S1PR1 (0.51) DPP4DPP8DPP9DPP7FAP
SCHEMBL23211432 0.80 DPP4 (0.50) DPP4DPP8DPP9DPP7FAP
SCHEMBL23211434 0.80 DPP4 (0.50) DPP4DPP8DPP9DPP7FAP
SCHEMBL28499545 0.78 ALDH1A1 (0.50) DPP4DPP8DPP9DPP7FAP
SCHEMBL29910014 0.78 ALDH1A1 (0.50) DPP4DPP8DPP9DPP7FAP
SCHEMBL23211486 0.77 DPP4 (0.57) DPP4DPP8DPP9DPP7FAP
SCHEMBL23211484 0.77 DPP4 (0.57) DPP4DPP8DPP9DPP7FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174685-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-05-30 US disclosed
US-11905297-B2 OX2R compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2024-02-20 US disclosed
US-20230122024-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-04-20 US disclosed
US-11479560-B2 OX2R compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2022-10-25 US disclosed
US-11472813-B2 OX2R compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-10-18 US disclosed
US-20210163494-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-06-03 US disclosed
US-20210107914-A1 OX2R Compounds BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-04-15 US disclosed
CN-112165940-A OX2R compound 德克萨斯州立大学董事会 2021-01-01 CN 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 (7 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-11479560-B2 OX2R compounds HCRTR2, HCRTR1, OXTR DPP4 4445/4885DPP8 4182/4885DPP9 4589/4885
US-11905297-B2 OX2R compounds HCRTR2, HCRTR1, OXTR DPP4 4445/4885DPP8 4182/4885DPP9 4589/4885
US-20240174685-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR DPP4 4445/4885DPP8 4182/4885DPP9 4589/4885
US-20210107914-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR DPP4 4445/4885DPP8 4182/4885DPP9 4589/4885
US-20230122024-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR DPP4 4445/4885DPP8 4182/4885DPP9 4589/4885
US-11472813-B2 OX2R compounds HCRTR2, HCRTR1, OXTR DPP4 4445/4885DPP8 4182/4885DPP9 4589/4885
US-20210163494-A1 OX2R Compounds HCRTR2, HCRTR1, OXTR DPP4 4445/4885DPP8 4182/4885DPP9 4589/4885

“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.