SCHEMBL27945693

SCHEMBL27945693

NC(=O)/C=C/C(=O)Nc1ccc(Br)c(Br)c1Br

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.48
▸ MAPT P10636 6/20 0.48
▸ HTT P42858 4/20 0.48
▸ GAA P10253 2/20 0.48
▸ DDAH1 O94760 1/20 0.46
▸ LMNA P02545 3/20 0.44
▸ MCL1 Q07820 1/20 0.44
▸ PKM P14618 3/20 0.43
▸ NLRP1 Q9C000 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.40
▸ EGFR P00533 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ POLB P06746 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CYP2C19 P33261 1/20 0.36
▸ LPAR2 Q9HBW0 1/20 0.36
▸ LPAR3 Q9UBY5 1/20 0.36
▸ KIF11 P52732 1/20 0.36

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
SCHEMBL27823770 0.78 KIF11 (0.53) ALDH1A1MAPTHTTGAALMNA
SCHEMBL5495518 0.77 TGM2 (0.50) LMNAEGFRCYP2C19
SCHEMBL5086029 0.74 ALDH1A1 (0.70) ALDH1A1MAPTHTTGAADDAH1
SCHEMBL5176144 0.70 MMP1 (0.65) ALDH1A1MAPTHTTGAADDAH1
SCHEMBL5177059 0.70 MMP1 (0.65) ALDH1A1MAPTHTTGAADDAH1
SCHEMBL5176155 0.70 MMP1 (0.65) ALDH1A1MAPTHTTGAADDAH1
SCHEMBL2429556 0.70 ALDH1A1 (0.81) ALDH1A1MAPTHTTGAADDAH1
SCHEMBL27393760 0.70 CCNC (0.42) ALDH1A1MAPTHTTGAADDAH1
SCHEMBL28100882 0.69 ALDH1A1 (0.45) ALDH1A1MAPTHTTGAADDAH1
SCHEMBL28884330 0.68 ALDH1A1 (0.65) ALDH1A1MAPTHTTGAADDAH1

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-103443873-B Cable 矢崎总业株式会社 2016-10-12 — — CN disclosed
CN-103443873-A Electric cable YAZAKI CORP 2013-12-11 — — CN disclosed
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