SCHEMBL7366501

SCHEMBL7366501

CC(C)(C)OC(=O)c1cc2ccc(NC(=O)c3cc(NS(C)(=O)=O)ccc3NC(=O)c3ccc(C(C)(C)C)cc3)cc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.47
NR1H4 Q96RI1 15/20 0.45
PPARG P37231 6/20 0.45
PPARA Q07869 5/20 0.45
HPGD P15428 2/20 0.42
MAPK10 P53779 1/20 0.42
MMP2 P08253 1/20 0.41
MMP13 P45452 1/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
PPARD Q03181 1/20 0.40

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
SCHEMBL6180125 0.94 NR1H4 (0.44) F10NR1H4PPARGPPARAHPGD
SCHEMBL7372132 0.88 NR1H4 (0.43) F10NR1H4PPARGPPARAALDH1A1
SCHEMBL7367092 0.87 NR1H4 (0.46) F10NR1H4PPARGPPARAPPARD
SCHEMBL7370555 0.87 NR1H4 (0.59) NR1H4PPARGPPARAPPARD
SCHEMBL7367665 0.84 RAB9A (0.48) NR1H4PPARGPPARAHPGDALDH1A1
SCHEMBL7373592 0.84 NR1H4 (0.43) NR1H4PPARGPPARAALDH1A1MAPK1
SCHEMBL6172966 0.83 NR1H4 (0.46) NR1H4PPARGPPARAPPARD
SCHEMBL7371060 0.82 F10 (0.46) F10NR1H4PPARGPPARAHPGD
SCHEMBL6169846 0.82 ESR1 (0.55) F10NR1H4PPARGPPARA
SCHEMBL6169988 0.80 MAP4K4 (0.53) F10NR1H4PPARGPPARAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1019045-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2002-07-03 EP disclosed
EP-1019045-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-07-19 EP disclosed
WO-1999000128-A9 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 1999-08-05 WO disclosed
WO-1999000128-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1999-01-07 WO disclosed