SCHEMBL28533592

SCHEMBL28533592

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

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ALPL P05186 1/20 0.33
▸ PDE11A Q9HCR9 1/20 0.32
▸ HCRTR1 O43613 4/20 0.31
▸ HCRTR2 O43614 4/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ FGFR1 P11362 2/20 0.31
▸ SRC P12931 2/20 0.31
▸ GHSR Q92847 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
SCHEMBL28525371 0.92 DHODH (0.34) DHODH
SCHEMBL28517108 0.91 DHODH (0.33) DHODH
SCHEMBL28518924 0.90 DHODH (0.36) DHODHALDH1A1MAPTALPLCNR1
SCHEMBL29181573 0.90 DHODH (0.36) DHODHALDH1A1MAPTL3MBTL1ALPL
SCHEMBL28524894 0.90 DHODH (0.35) DHODH
SCHEMBL24397881 0.90 DHODH (0.35) DHODHALDH1A1MAPTL3MBTL1ALPL
SCHEMBL28529762 0.87 DHODH (0.34) DHODHMAPTL3MBTL1KDM4E
SCHEMBL28524478 0.86 DHODH (0.34) DHODH
SCHEMBL28530956 0.86 DHODH (0.34) DHODH
SCHEMBL28523115 0.86 DHODH (0.33) DHODH

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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