SCHEMBL28523981

SCHEMBL28523981

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

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.39
▸ MALT1 Q9UDY8 3/20 0.33
▸ EPHX2 P34913 1/20 0.32
▸ PHGDH O43175 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ GRM4 Q14833 1/20 0.31
▸ MET P08581 1/20 0.30
▸ RIPK1 Q13546 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
SCHEMBL28907444 0.94 DHODH (0.39) DHODHMALT1EPHX2PHGDHRAB9A
SCHEMBL28529665 0.83 MEN1 (0.38) DHODHMALT1GRM4
SCHEMBL28525370 0.83 DHODH (0.37) DHODHHPGD
SCHEMBL28531177 0.82 MEN1 (0.42) DHODHRAB9AGRM4
SCHEMBL24397959 0.81 DHODH (0.39) DHODHMALT1EPHX2
SCHEMBL28518924 0.81 DHODH (0.36) DHODHMALT1
SCHEMBL28524894 0.81 DHODH (0.35) DHODH
SCHEMBL28455051 0.81 DHODH (0.42) DHODHMALT1EPHX2
SCHEMBL24397868 0.80 DHODH (0.38) DHODHMALT1EPHX2HPGD
SCHEMBL28523976 0.80 DHODH (0.38) DHODHMALT1

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-110066270-B Polyamide compound and preparation method and application thereof 湖南化工研究院有限公司 2021-02-26 — — CN claimed
CN-110066270-B Polyamide compound and preparation method and application thereof 湖南化工研究院有限公司 2021-02-26 — — CN disclosed
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