SCHEMBL21612864

SCHEMBL21612864

Cc1sc(NC(=O)C(C)OC(N)=O)c(C(=O)c2ccc(Cl)cc2)c1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.55
▸ MAPT P10636 8/20 0.55
▸ LMNA P02545 4/20 0.55
▸ HPGD P15428 7/20 0.50
▸ MAPK1 P28482 2/20 0.50
▸ PLA2G1B P04054 1/20 0.50
▸ ATG4B Q9Y4P1 1/20 0.50
▸ TP53 P04637 3/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ NPSR1 Q6W5P4 3/20 0.46
▸ HTT P42858 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ FLT3 P36888 1/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ CASP1 P29466 1/20 0.46
▸ RAB9A P51151 1/20 0.46

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
SCHEMBL21612863 1.00 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL30012531 0.84 ALDH1A1 (0.60) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL15185722 0.81 ALDH1A1 (0.62) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL31498738 0.81 ALDH1A1 (0.54) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL23801147 0.80 ALDH1A1 (0.58) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL23801148 0.80 ALDH1A1 (0.58) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL31498681 0.79 ALDH1A1 (0.57) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL17165584 0.79 ALDH1A1 (0.57) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL17165585 0.79 ALDH1A1 (0.57) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL30411459 0.77 ALDH1A1 (0.53) ALDH1A1MAPTLMNAHPGDMAPK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020009176-A1 AMIDE COMPOUND HAVING BET PROTEOLYSIS-INDUCING ACTION AND MEDICINAL APPLICATION THEREOF 田辺三菱製薬株式会社 2020-01-09 — — WO disclosed
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