SCHEMBL28460583

SCHEMBL28460583

CCN(CC)C(=O)c1cc(Br)cc(C)c1N(CC)C(=O)c1cc(Br)nn1-c1ncccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.38
▸ LMNA P02545 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ PDE11A Q9HCR9 2/20 0.34
▸ HCRTR1 O43613 7/20 0.33
▸ HCRTR2 O43614 7/20 0.33
▸ MALT1 Q9UDY8 1/20 0.33
▸ CYP2C9 P11712 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ NR1H2 P55055 1/20 0.31
▸ NR1H3 Q13133 1/20 0.31

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
SCHEMBL28451453 0.91 DHODH (0.38) DHODHLMNAGFERPDE11AHCRTR1
SCHEMBL29181573 0.89 DHODH (0.36) DHODHLMNAPDE11AHCRTR1HCRTR2
SCHEMBL28451679 0.88 DHODH (0.35) DHODHLMNAGFERPDE11AHCRTR1
SCHEMBL29181524 0.86 DHODH (0.36) DHODHLMNAGFERMALT1CYP2C9
SCHEMBL29181541 0.86 DHODH (0.36) DHODHLMNAGFERMALT1CYP2C9
Hydrochloric Acid SCHEMBL29181543 0.86 DHODH (0.36) DHODHLMNAGFERMALT1CYP2C9
SCHEMBL29181509 0.85 DHODH (0.35) DHODHLMNAGFERCYP2C9ALDH1A1
SCHEMBL29181530 0.85 DHODH (0.35) DHODHLMNAGFERCYP2C9ALDH1A1
Hydrochloric Acid SCHEMBL29181511 0.84 DHODH (0.35) DHODHLMNAGFERCYP2C9ALDH1A1
SCHEMBL28451074 0.82 DHODH (0.36) DHODHLMNACYP2C9ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116264894-A Preparation and application of 1-pyridylpyrazole amide compound 湖南化工研究院有限公司 2023-06-20 — — 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-111662269-B 1-pyridyl pyrazole amide compound and preparation method and application thereof 湖南化工研究院有限公司 2021-05-07 — — CN claimed
CN-111662269-A 1-pyridyl pyrazole amide compound and preparation method and application thereof 湖南化工研究院有限公司 2020-09-15 — — CN claimed
CN-116264894-B Preparation and application of 1-pyridylpyrazole amide compound 湖南化工研究院有限公司 2024-07-09 — — CN disclosed
CN-116264894-A Preparation and application of 1-pyridylpyrazole amide compound 湖南化工研究院有限公司 2023-06-20 — — 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
CN-111662269-B 1-pyridyl pyrazole amide compound and preparation method and application thereof 湖南化工研究院有限公司 2021-05-07 — — CN disclosed
CN-111662269-A 1-pyridyl pyrazole amide compound and preparation method and application thereof 湖南化工研究院有限公司 2020-09-15 — — CN disclosed
Send feedback