SCHEMBL7368382

SCHEMBL7368382

CC(C)(C)OC(=O)c1cc(NC(=O)c2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)cc2[nH]nc(Cl)c12

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 17/20 0.55
PPARG P37231 13/20 0.55
PPARA Q07869 7/20 0.55
PPARD Q03181 1/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GLA P06280 1/20 0.47
RAB9A P51151 1/20 0.47
ATM Q13315 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
RXFP1 Q9HBX9 1/20 0.43

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
SCHEMBL7367677 0.90 NR1H4 (0.54) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL7365516 0.83 FADS1 (0.47) NPC1ALDH1A1RAB9ARXFP1
SCHEMBL6172308 0.81 NR1H4 (0.64) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL7370255 0.80 KMT2A (0.46) ALDH1A1GLARAB9AL3MBTL1
SCHEMBL7373717 0.80 NR1H4 (0.57) NR1H4PPARGPPARAPPARD
SCHEMBL7370555 0.75 NR1H4 (0.59) NR1H4PPARGPPARAPPARDRXFP1
SCHEMBL6171509 0.74 NR1H4 (0.63) NR1H4PPARGPPARAPPARDRXFP1
SCHEMBL7364732 0.73 P2RX1 (0.43) NPC1ALDH1A1RAB9ARXFP1
SCHEMBL5226687 0.72 NPC1 (0.74) NR1H4PPARGPPARAPPARDNPC1
SCHEMBL7368426 0.72 NPC1 (0.54) NR1H4PPARGPPARAPPARDNPC1

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