SCHEMBL7996903

SCHEMBL7996903

Cc1ccc(CCOc2ccc(CC3SC(=O)NC3=O)cc2)c(NC(N)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.51
CYP3A4 P08684 2/20 0.50
RXRA P19793 1/20 0.50
FFAR1 O14842 10/20 0.48
MPC2 O95563 1/20 0.47
CYP2C8 P10632 1/20 0.47
CYP2C9 P11712 1/20 0.47
PPARA Q07869 2/20 0.47
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HRH3 Q9Y5N1 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
SCHEMBL7998437 0.82 PPARG (0.56) PPARGCYP3A4RXRAFFAR1MPC2
SCHEMBL19559777 0.75 FFAR1 (0.61) PPARGCYP3A4RXRAFFAR1PPARA
SCHEMBL8792805 0.75 PPARG (0.66) PPARGCYP3A4RXRAFFAR1MPC2
SCHEMBL14188614 0.74 PPARG (0.67) PPARGCYP3A4RXRAFFAR1MPC2
SCHEMBL7996899 0.74 PPARG (0.56) PPARGCYP3A4RXRAFFAR1MPC2
SCHEMBL21504844 0.74 FFAR1 (0.59) PPARGCYP3A4RXRAFFAR1MPC2
SCHEMBL8792201 0.74 PPARG (0.80) PPARGCYP3A4RXRAFFAR1MPC2
SCHEMBL3900449 0.73 FFAR1 (0.62) PPARGCYP3A4RXRAFFAR1MPC2
SCHEMBL12515224 0.73 FFAR1 (0.69) PPARGCYP3A4RXRAFFAR1PPARA
SCHEMBL6931578 0.73 FFAR1 (0.59) PPARGCYP3A4RXRAFFAR1PPARA

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