SCHEMBL21558089

SCHEMBL21558089

CCOCC1(C#N)CCCC1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.40
HIF1A Q16665 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL17146470 0.91
SCHEMBL23084093 0.82 DPP4 (0.32) DPP4
SCHEMBL23086702 0.80 DPP4 (0.46) DPP4ALDH1A1
SCHEMBL21558067 0.78 DPP4 (0.34) DPP4
SCHEMBL23086688 0.77 DPP4 (0.36) DPP4ALDH1A1
SCHEMBL6201919 0.76 ALDH1A1 (0.36) DPP4ALDH1A1
SCHEMBL2292115 0.74
SCHEMBL19601432 0.73
SCHEMBL878835 0.72 ALDH1A1 (0.40) ALDH1A1
SCHEMBL11299703 0.72 ALDH1A1 (0.40) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12319683-B2 Azabenzimidazole compounds and pharmaceutical NIPPON SHINYAKU CO., LTD. (JP) 2025-06-03 US disclosed
EP-3792260-B1 AZABENZIMIDAZOLE COMPOUNDS AND PHARMACEUTICAL NIPPON SHINYAKU CO LTD (JP) 2024-09-11 EP disclosed
CN-112368282-B Azabenzimidazole compounds and medicaments 日本新药株式会社 2023-10-13 CN disclosed
US-20230002395-A1 AZABENZIMIDAZOLE COMPOUND AND MEDICINE NIPPON SHINYAKU CO., LTD. (JP) 2023-01-05 US disclosed
US-20230000840-A1 THERAPEUTIC AGENTS AND PROPHYLACTIC AGENTS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS AND XEROSTOMIA NIPPON SHINYAKU CO., LTD. (JP) 2023-01-05 US disclosed
EP-4059503-A1 THERAPEUTIC AGENT AND PROPHYLACTIC AGENT FOR FUNCTIONAL GASTROINTESTINAL DISORDERS AND XEROSTOMIA Nippon Shinyaku Co., Ltd. (JP) 2022-09-21 EP disclosed
EP-4059933-A1 AZABENZIMIDAZOLE COMPOUND AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2022-09-21 EP disclosed
CN-114929697-A Azabenzimidazole compounds and medicaments 日本新药株式会社 2022-08-19 CN disclosed
CN-114901283-A Therapeutic and prophylactic agent for functional digestive tract disorder and xerostomia 日本新药株式会社 2022-08-12 CN disclosed
US-20210371412-A1 AZABENZIMIDAZOLE COMPOUNDS AND PHARMACEUTICAL NIPPON SHINYAKU CO., LTD. (JP) 2021-12-02 US disclosed
WO-2021095805-A1 THERAPEUTIC AGENT AND PROPHYLACTIC AGENT FOR FUNCTIONAL GASTROINTESTINAL DISORDERS AND XEROSTOMIA 日本新薬株式会社 2021-05-20 WO disclosed
WO-2021095801-A1 AZABENZIMIDAZOLE COMPOUND AND MEDICINE 日本新薬株式会社 2021-05-20 WO disclosed
EP-3792260-A1 AZABENZIMIDAZOLE COMPOUNDS AND PHARMACEUTICAL Nippon Shinyaku Co., Ltd. (JP) 2021-03-17 EP disclosed
CN-112368282-A Azabenzimidazole compounds and pharmaceuticals 日本新药株式会社 2021-02-12 CN disclosed
WO-2019216294-A1 AZABENZIMIDAZOLE COMPOUNDS AND PHARMACEUTICAL 日本新薬株式会社 (JP) 2019-11-14 WO 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 (4 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-20230002395-A1 AZABENZIMIDAZOLE COMPOUND AND MEDICINE PAM, CHRM3, AZI2 DPP4 210/4885HIF1A 4227/4885ALDH1A1 383/4885
US-20210371412-A1 AZABENZIMIDAZOLE COMPOUNDS AND PHARMACEUTICAL PAM, CHRM3, AZI2 DPP4 419/4885HIF1A 4331/4885ALDH1A1 480/4885
US-20230000840-A1 THERAPEUTIC AGENTS AND PROPHYLACTIC AGENTS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS AND XEROSTOMIA ALPI, SI, AZI2 DPP4 257/4885HIF1A 3842/4885ALDH1A1 1074/4885
US-12319683-B2 Azabenzimidazole compounds and pharmaceutical PAM, CHRM3, AZI2 DPP4 419/4885HIF1A 4331/4885ALDH1A1 480/4885

“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.