SCHEMBL28451477

SCHEMBL28451477

CN(C(=O)c1cc(Br)nn1-c1ncccc1Cl)c1c(Cl)cc(Cl)cc1C(=O)NC1CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ PDE4B Q07343 6/20 0.39
▸ PDE4D Q08499 3/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ CRHR1 P34998 3/20 0.38
▸ DHODH Q02127 2/20 0.37
▸ CNR1 P21554 1/20 0.36
▸ GRM4 Q14833 1/20 0.36
▸ CRHR2 Q13324 1/20 0.36
▸ MALT1 Q9UDY8 2/20 0.35

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
SCHEMBL28451724 0.94 MEN1 (0.39) MEN1KMT2APDE4BPDE4DCYP1A2
SCHEMBL24397959 0.89 DHODH (0.39) DHODHMALT1
SCHEMBL29019777 0.88 DHODH (0.37) DHODHMALT1
SCHEMBL28455067 0.87 POLB (0.39) MEN1KMT2APDE4BPDE4DDHODH
SCHEMBL28451020 0.86 DHODH (0.38) DHODHCNR1
SCHEMBL24397793 0.86 CHIA (0.39) PDE4BDHODHCNR1
SCHEMBL28457029 0.86 HPGD (0.36) PDE4BPDE4DDHODHCNR1MALT1
SCHEMBL28460725 0.86 DHODH (0.38) DHODHCNR1
SCHEMBL28457031 0.86 DHODH (0.36) PDE4BPDE4DDHODHMALT1
SCHEMBL24397797 0.86 DHODH (0.37) MEN1KMT2ADHODHCNR1MALT1

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
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-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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