SCHEMBL24397879

SCHEMBL24397879

CCN(CC)C(=O)c1cc(Cl)cc(Cl)c1NC

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 4/20 0.49
▸ ALDH1A1 P00352 2/20 0.46
▸ HSP90AA1 P07900 4/20 0.45
▸ HSP90AB1 P08238 3/20 0.45
▸ ALPL P05186 1/20 0.45
▸ MAPT P10636 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CYP3A4 P08684 1/20 0.43
▸ KEAP1 Q14145 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ GABRA2 P47869 1/20 0.39
▸ GABRB2 P47870 1/20 0.39

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
SCHEMBL28455365 0.86 CYP3A4 (0.42) CRHR1ALDH1A1HSP90AA1ALPLL3MBTL1
SCHEMBL29606642 0.86 CYP3A4 (0.42) CRHR1ALDH1A1HSP90AA1ALPLL3MBTL1
SCHEMBL29606632 0.85 HPGD (0.40) CRHR1ALDH1A1HSP90AA1HSP90AB1ALPL
SCHEMBL24397796 0.82 HPGD (0.48) ALDH1A1ALPLMAPTKEAP1SLC6A3
SCHEMBL30704844 0.81 ALDH1A1 (0.46) CRHR1ALDH1A1ALPLL3MBTL1CYP3A4
SCHEMBL11689552 0.78 ALDH1A1 (0.51) CRHR1ALDH1A1HSP90AA1HSP90AB1ALPL
SCHEMBL28898749 0.77 ALDH1A1 (0.37) ALDH1A1MAPTCYP3A4NPC1RAB9A
SCHEMBL29606902 0.77 ALDH1A1 (0.37) ALDH1A1MAPTCYP3A4NPC1RAB9A
SCHEMBL8574746 0.77 ALDH1A1 (0.53) ALDH1A1HSP90AA1HSP90AB1ALPLMAPT
SCHEMBL28794509 0.76 AKR1C4 (0.55) ALDH1A1MAPTCYP3A4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117285508-A Preparation method of pyridyl pyrazole amide compound and intermediate thereof 湖南化工研究院有限公司 2023-12-26 — — CN claimed
CN-114516855-A Preparation of pyridylpyrazole amide compounds and intermediates therefor 湖南化工研究院有限公司 2022-05-20 — — CN claimed
CN-114516854-A Preparation method of 1-pyridyl pyrazole amide compound and intermediate thereof 湖南化工研究院有限公司 2022-05-20 — — CN claimed
CN-117285508-A Preparation method of pyridyl pyrazole amide compound and intermediate thereof 湖南化工研究院有限公司 2023-12-26 — — CN disclosed
CN-114516855-A Preparation of pyridylpyrazole amide compounds and intermediates therefor 湖南化工研究院有限公司 2022-05-20 — — CN disclosed
CN-114516854-A Preparation method of 1-pyridyl pyrazole amide compound and intermediate thereof 湖南化工研究院有限公司 2022-05-20 — — CN disclosed
US-20220132846-A1 1-PYRIDYL-PYRAZOLYL AMIDE COMPOUNDS AND PREPARATION AND USES THEREOF HUNAN RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CO., LTD. (CN) 2022-05-05 — — 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-20220132846-A1 1-PYRIDYL-PYRAZOLYL AMIDE COMPOUNDS AND PREPARATION AND USES THEREOF ACHE, PDHB, PDXK CRHR1 4546/4885ALDH1A1 419/4885HSP90AA1 3652/4885

“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.

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