SCHEMBL13537320

SCHEMBL13537320

Cn1cc(C(=O)C(=O)N2CCCC2)c2cc(N=O)ccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 3/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ATM Q13315 1/20 0.39
▸ LMNA P02545 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ POLB P06746 2/20 0.37
▸ NR4A2 P43354 2/20 0.37
▸ CHRM2 P08172 2/20 0.36
▸ ADRA2A P08913 2/20 0.36
▸ CHRM1 P11229 2/20 0.36
▸ ADRA2B P18089 2/20 0.36
▸ CHRM3 P20309 2/20 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
SCHEMBL13537323 0.99 ALOX5 (0.42) ALOX5KMT2AALDH1A1RAB9ANPC1
SCHEMBL13537346 0.91 KMT2A (0.44) ALOX5KMT2AALDH1A1RAB9ANPC1
SCHEMBL13537324 0.89 ALOX5 (0.46) ALOX5KMT2AALDH1A1RAB9ANPC1
SCHEMBL3358211 0.78 MAPT (0.47) ALOX5KMT2AALDH1A1RAB9ANPC1
SCHEMBL3351542 0.77 ALDH1A1 (0.46) ALOX5KMT2AALDH1A1RAB9ANPC1
SCHEMBL13537325 0.75 ALDH1A1 (0.42) KMT2AALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL2075770 0.71 POLB (0.47) ALOX5KMT2AALDH1A1RAB9ANPC1
SCHEMBL3353911 0.70 ALDH1A1 (0.45) KMT2AALDH1A1RAB9ANPC1L3MBTL1
SCHEMBL1559389 0.69 KMT2A (0.65) ALOX5KMT2AALDH1A1RAB9ANPC1
SCHEMBL13537395 0.69 HTR6 (0.43) HTR2AHTR1D

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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