SCHEMBL28525370

SCHEMBL28525370

CC(=O)N(C(=O)c1cc(Br)nn1-c1ncccc1Cl)c1c(Cl)cc(Cl)cc1C(=O)NC(C)C

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.37
▸ PDE4A P27815 2/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ CNR1 P21554 3/20 0.33
▸ CNR2 P34972 3/20 0.33
▸ ALPL P05186 1/20 0.32
▸ MAPT P10636 3/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ RBP4 P02753 1/20 0.31
▸ POLB P06746 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ PKM P14618 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
SCHEMBL28451020 0.90 DHODH (0.38) DHODHPDE4AKCNH2CNR1CNR2
SCHEMBL28455280 0.88 DHODH (0.37) DHODHPDE4AKCNH2CNR1CNR2
SCHEMBL28529762 0.87 DHODH (0.34) DHODHMAPTPOLBKDM4ENPSR1
SCHEMBL28518924 0.87 DHODH (0.36) DHODHCNR1CNR2ALPLMAPT
SCHEMBL28524894 0.86 DHODH (0.35) DHODH
SCHEMBL28456798 0.86 DHODH (0.37) DHODHPDE4AKCNH2CNR1CNR2
SCHEMBL28460689 0.86 DHODH (0.40) DHODHPDE4AKCNH2CNR1CNR2
SCHEMBL28525743 0.85 DHODH (0.33) DHODH
SCHEMBL28533592 0.85 DHODH (0.34) DHODHCNR1CNR2ALPLMAPT
SCHEMBL28525371 0.84 DHODH (0.34) 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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