SCHEMBL28518924

SCHEMBL28518924

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

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.36
▸ CNR2 P34972 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.32
▸ CNR1 P21554 1/20 0.32
▸ AVPR1A P37288 2/20 0.31
▸ TRPA1 O75762 2/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ MALT1 Q9UDY8 1/20 0.30
▸ PTGS1 P23219 1/20 0.30
▸ RBP4 P02753 1/20 0.30
▸ ALPL P05186 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
SCHEMBL28524894 0.94 DHODH (0.35) DHODHAVPR1ATRPA1
SCHEMBL28525371 0.91 DHODH (0.34) DHODH
SCHEMBL28533592 0.90 DHODH (0.34) DHODHCNR2ALDH1A1CNR1MAPT
SCHEMBL28517108 0.90 DHODH (0.33) DHODH
SCHEMBL24397797 0.90 DHODH (0.37) DHODHCNR2ALDH1A1CNR1AVPR1A
SCHEMBL28529762 0.90 DHODH (0.34) DHODHMAPT
SCHEMBL28523115 0.88 DHODH (0.33) DHODHMALT1
SCHEMBL28528321 0.88 DHODH (0.35) DHODHAVPR1A
SCHEMBL28530953 0.88 DHODH (0.38) DHODHAVPR1AMALT1
SCHEMBL28451074 0.87 DHODH (0.36) DHODHCNR2ALDH1A1CNR1AVPR1A

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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