SCHEMBL7998059

SCHEMBL7998059

O=C1NC(=O)C(Cc2ccc(OCCc3ccc(OS(=O)(=O)c4ccccc4)cc3)cc2)S1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.59
FFAR1 O14842 10/20 0.58
PPARG P37231 9/20 0.57
CYP3A4 P08684 1/20 0.53
RXRA P19793 1/20 0.53
PPARA Q07869 2/20 0.52
HRH3 Q9Y5N1 1/20 0.50

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
SCHEMBL8003795 0.90 FFAR1 (0.56) PTPN1FFAR1PPARGCYP3A4RXRA
SCHEMBL12515224 0.88 FFAR1 (0.69) FFAR1PPARGCYP3A4RXRAPPARA
SCHEMBL8000465 0.85 FFAR1 (0.47) PTPN1FFAR1PPARGCYP3A4RXRA
SCHEMBL7987731 0.85 PPARG (0.55) FFAR1PPARGCYP3A4RXRAPPARA
SCHEMBL8000477 0.84 PPARG (0.60) PTPN1FFAR1PPARGCYP3A4RXRA
SCHEMBL7996885 0.83 PPARG (0.61) FFAR1PPARGCYP3A4RXRAPPARA
SCHEMBL7996997 0.82 PPARG (0.58) FFAR1PPARGCYP3A4RXRAPPARA
SCHEMBL1072226 0.81 FFAR1 (0.77) FFAR1PPARGCYP3A4PPARAHRH3
SCHEMBL12628242 0.81 PPARG (0.63) FFAR1PPARGCYP3A4RXRAPPARA
Ploglitazone SCHEMBL12160093 0.79 PPARG (0.75) FFAR1PPARGCYP3A4RXRAPPARA

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