SCHEMBL7998360

SCHEMBL7998360

CS(=O)(=O)Oc1ccccc1CCOc1ccc(C=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
MAPT P10636 4/20 0.43
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43
STS P08842 1/20 0.42
PPARG P37231 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.39
ATM Q13315 1/20 0.39
KDM4E B2RXH2 1/20 0.39
RAB9A P51151 1/20 0.38
PPARD Q03181 1/20 0.38
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
DRD4 P21917 1/20 0.36
DRD5 P21918 1/20 0.36
DRD3 P35462 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 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
SCHEMBL15079864 0.86 L3MBTL1 (0.49) MAPTHPGDSMN1; SMN2PPARGL3MBTL1
SCHEMBL7998391 0.86 ALDH1A1 (0.43) ALDH1A1MAPTHPGDSMN1; SMN2LMNA
SCHEMBL7996933 0.80 HPGD (0.62) HPGDPPARGPTPN1
SCHEMBL7987959 0.80 HPGD (0.62) HPGDPPARGPTPN1
SCHEMBL7987761 0.78 ALDH1A1 (0.55) ALDH1A1MAPTHPGDSMN1; SMN2LMNA
SCHEMBL7996977 0.75 ALDH1A1 (0.46) ALDH1A1MAPTHPGDSMN1; SMN2LMNA
SCHEMBL3171854 0.75 TAAR1 (0.41) ALDH1A1MAPTLMNAL3MBTL1KDM4E
SCHEMBL8000471 0.75 ALDH1A1 (0.52) ALDH1A1MAPTHPGDSMN1; SMN2LMNA
SCHEMBL7800280 0.73 TAAR1 (0.56) ALDH1A1MAPTHPGDSMN1; SMN2LMNA
SCHEMBL9311261 0.72 RAB9A (0.55) ALDH1A1MAPTHPGDSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6288096-B1 ANTIDIABETIC AGENTS, HYPOTENSIVE AGENTS, AND ANTICHOLESTEROL AGENTS ASTRAZENECA AB (SE) 2001-09-11 US disclosed
EP-0991632-A1 NEW THIAZOLIDINEDIONE, OXAZOLIDINEDIONE AND OXADIAZOLIDINEDIONE DERIVATIVES Astra Aktiebolag (SE) 2000-04-12 EP disclosed
WO-1998057941-A1 NEW THIAZOLIDINEDIONE, OXAZOLIDINEDIONE AND OXADIAZOLIDINEDIONE DERIVATIVES ASTRA AKTIEBOLAG (SE) 1998-12-23 WO disclosed