SCHEMBL29181563

SCHEMBL29181563

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

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ TRPA1 O75762 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 SCHEMBL29181549 0.99 DHODH (0.34) DHODHSMN1; SMN2L3MBTL1TRPA1
SCHEMBL29181534 0.95 DHODH (0.34) DHODHTRPA1
SCHEMBL29181558 0.95 DHODH (0.35) DHODHSMN1; SMN2L3MBTL1TRPA1
Hydrochloric Acid SCHEMBL29181582 0.94 DHODH (0.33) DHODHTRPA1
Hydrochloric Acid SCHEMBL29181577 0.94 DHODH (0.35) DHODHSMN1; SMN2L3MBTL1TRPA1
SCHEMBL29181545 0.93 DHODH (0.34) DHODHTRPA1
SCHEMBL29181599 0.93 DHODH (0.34) DHODHSMN1; SMN2L3MBTL1
SCHEMBL29181514 0.93 DHODH (0.35) DHODHSMN1; SMN2TRPA1
Hydrochloric Acid SCHEMBL29181589 0.92 DHODH (0.34) DHODHSMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL29181532 0.92 DHODH (0.35) DHODHSMN1; SMN2TRPA1

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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