SCHEMBL29181564

SCHEMBL29181564

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

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MALT1 Q9UDY8 10/20 0.35
▸ KMT2A Q03164 1/20 0.34
▸ DHODH Q02127 3/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ CCR3 P51677 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TRPA1 O75762 1/20 0.32
▸ CHRM4 P08173 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
Hydrochloric Acid SCHEMBL29181586 0.99 MALT1 (0.34) MALT1KMT2ADHODHHRH1CCR3
SCHEMBL29181555 0.94 MALT1 (0.35) MALT1KMT2ADHODHHRH1CCR3
Hydrochloric Acid SCHEMBL29181566 0.93 MALT1 (0.35) MALT1KMT2ADHODHHRH1CCR3
SCHEMBL29181584 0.93 DHODH (0.33) MALT1DHODHALDH1A1TRPA1
SCHEMBL29181518 0.93 MALT1 (0.35) MALT1KMT2ADHODHHRH1CCR3
Hydrochloric Acid SCHEMBL29181505 0.92 MALT1 (0.34) MALT1KMT2ADHODHHRH1CCR3
SCHEMBL29181542 0.89 MALT1 (0.35) MALT1KMT2ADHODHHRH1CCR3
Hydrochloric Acid SCHEMBL29181571 0.88 MALT1 (0.35) MALT1KMT2ADHODHHRH1CCR3
SCHEMBL29181562 0.87 DHODH (0.34) MALT1DHODHALDH1A1TRPA1
SCHEMBL29181503 0.86 MALT1 (0.35) MALT1DHODHALDH1A1TRPA1

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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