SCHEMBL29181568

SCHEMBL29181568

O=C(Cl)c1cc(Cl)cc(Cl)c1N(C(=O)c1cc(Br)nn1-c1ncccc1Cl)C1CC1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 9/20 0.35
▸ TRPA1 O75762 3/20 0.34
▸ DHODH Q02127 3/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32

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
SCHEMBL29181503 0.94 MALT1 (0.35) MALT1TRPA1DHODHALDH1A1TRPV1
SCHEMBL29181542 0.93 MALT1 (0.35) MALT1TRPA1DHODHALDH1A1KDM4E
SCHEMBL29181562 0.93 DHODH (0.34) MALT1TRPA1DHODHALDH1A1TRPV1
Hydrochloric Acid SCHEMBL29181571 0.92 MALT1 (0.35) MALT1TRPA1DHODHALDH1A1KDM4E
SCHEMBL29181584 0.89 DHODH (0.33) MALT1TRPA1DHODHALDH1A1TRPV1
SCHEMBL29181518 0.87 MALT1 (0.35) MALT1TRPA1DHODHALDH1A1
Hydrochloric Acid SCHEMBL29181505 0.86 MALT1 (0.34) MALT1TRPA1DHODHALDH1A1
SCHEMBL29181555 0.86 MALT1 (0.35) MALT1TRPA1DHODHALDH1A1
SCHEMBL29181519 0.85 DHODH (0.37) MALT1TRPA1DHODHTRPV1
Hydrochloric Acid SCHEMBL29181566 0.85 MALT1 (0.35) MALT1TRPA1DHODHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117263908-A Preparation of 1-pyridylpyrazole amide compound and intermediate thereof 湖南化工研究院有限公司 2023-12-22 — — CN claimed
CN-117263908-A Preparation of 1-pyridylpyrazole amide compound and intermediate thereof 湖南化工研究院有限公司 2023-12-22 — — CN disclosed
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