SCHEMBL7987746

SCHEMBL7987746

CC(C)S(=O)(=O)Oc1ccc(CCOc2ccc(C=O)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
HPGD P15428 3/20 0.51
MAPT P10636 2/20 0.51
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PPARA Q07869 4/20 0.43
PPARG P37231 3/20 0.43
STS P08842 1/20 0.43
ALDH1A3 P47895 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
RAB9A P51151 1/20 0.39
PPARD Q03181 2/20 0.38
FFAR1 O14842 1/20 0.38
LTA4H P09960 1/20 0.37
CYP2A6 P11509 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
SCHEMBL7987761 0.85 ALDH1A1 (0.55) ALDH1A1HPGDMAPTLMNASMN1; SMN2
SCHEMBL2233336 0.80 TYR (0.58) ALDH1A1HPGDMAPTLMNASMN1; SMN2
SCHEMBL2232181 0.80 TYR (0.58) ALDH1A1HPGDMAPTLMNASMN1; SMN2
SCHEMBL4052107 0.80 ALDH1A1 (0.56) ALDH1A1HPGDMAPTLMNASMN1; SMN2
SCHEMBL7987766 0.80 HPGD (0.49) ALDH1A1HPGDMAPTLMNASMN1; SMN2
SCHEMBL8000501 0.79 HPGD (0.67) HPGD
SCHEMBL8000503 0.79 HPGD (0.67) HPGD
SCHEMBL7996910 0.79 ALDH1A1 (0.55) ALDH1A1HPGDMAPTLMNASMN1; SMN2
SCHEMBL2232274 0.78 ALDH1A1 (0.61) ALDH1A1HPGDMAPTLMNASMN1; SMN2
SCHEMBL2231178 0.78 ALDH1A1 (0.66) ALDH1A1HPGDMAPTLMNASMN1; 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 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