SCHEMBL13537324

SCHEMBL13537324

Cn1cc(C(=O)C(=O)N2CCOCC2)c2cc(N=O)ccc21

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.46
▸ ALDH1A1 P00352 7/20 0.44
▸ MAPT P10636 1/20 0.43
▸ GAA P10253 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ HTT P42858 1/20 0.37

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
SCHEMBL13537320 0.89 ALOX5 (0.42) ALOX5ALDH1A1LMNAMEN1KMT2A
SCHEMBL13537323 0.88 ALOX5 (0.42) ALOX5ALDH1A1LMNAMEN1KMT2A
SCHEMBL13537346 0.88 KMT2A (0.44) ALOX5ALDH1A1GAAKMT2ANPC1
SCHEMBL1558335 0.81 ALDH1A1 (0.60) ALOX5ALDH1A1MAPTGAALMNA
SCHEMBL3358890 0.80 POLB (0.52) ALOX5ALDH1A1MAPTGAALMNA
SCHEMBL13537325 0.72 ALDH1A1 (0.42) ALDH1A1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL13114473 0.71 KDM4E (0.59) ALDH1A1MAPTGAALMNAMEN1
SCHEMBL1559389 0.70 KMT2A (0.65) ALOX5ALDH1A1MAPTGAALMNA
SCHEMBL3358211 0.68 MAPT (0.47) ALOX5ALDH1A1MAPTGAALMNA
SCHEMBL23940225 0.68 HDAC6 (0.56) ALDH1A1MAPTLMNAKMT2ASMN1; SMN2

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
EP-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 — — EP disclosed
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