SCHEMBL28455295

SCHEMBL28455295

Cc1cc(Cl)cc(C(=S)N(C)C)c1N(C)C(=O)c1cc(Br)nn1-c1ncccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.38
▸ MALT1 Q9UDY8 4/20 0.35
▸ TRPV1 Q8NER1 2/20 0.32
▸ PHGDH O43175 1/20 0.30
▸ AVPR1A P37288 1/20 0.30
▸ CNR2 P34972 1/20 0.30
▸ TRPA1 O75762 1/20 0.30
▸ CYP17A1 P05093 1/20 0.30
▸ CYP1A2 P05177 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
SCHEMBL28457040 0.94 DHODH (0.36) DHODHMALT1AVPR1ACNR2TRPA1
SCHEMBL29019794 0.92 DHODH (0.40) DHODHMALT1TRPV1AVPR1ACNR2
SCHEMBL28455051 0.88 DHODH (0.42) DHODHMALT1TRPV1
SCHEMBL28460686 0.87 DHODH (0.38) DHODHMALT1TRPV1AVPR1A
SCHEMBL28455369 0.85 DHODH (0.37) DHODHMALT1CNR2
SCHEMBL28460689 0.85 DHODH (0.40) DHODHMALT1CNR2
SCHEMBL29019787 0.85 DHODH (0.34) DHODHCNR2
SCHEMBL28460999 0.85 DHODH (0.34) DHODH
SCHEMBL28458430 0.85 DHODH (0.40) DHODHMALT1
SCHEMBL24397797 0.85 DHODH (0.37) DHODHMALT1AVPR1ACNR2TRPA1

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
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