SCHEMBL6089164

SCHEMBL6089164

Cc1cccc(COc2cccc(OCc3ccc(-c4ccccc4)cn3)c2)c1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 4/20 0.47
MAP4K4 O95819 1/20 0.47
SLC26A4 O43511 1/20 0.46
NR4A2 P43354 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
ALOX5AP P20292 2/20 0.43
FFAR1 O14842 2/20 0.42
ALOX5 P09917 1/20 0.42
GPBAR1 Q8TDU6 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41
PTGER1 P34995 1/20 0.41
PTGER3 P43115 1/20 0.41
PTGER2 P43116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41

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
SCHEMBL6088597 0.90 CYSLTR1 (0.43) PTGER4MAP4K4ALOX5APFFAR1ALOX5
SCHEMBL6087956 0.85 PTGER4 (0.55) PTGER4SLC26A4NR4A2MRGPRX4FFAR1
SCHEMBL6091423 0.84 SLC26A4 (0.43) PTGER4SLC26A4NR4A2NPC1RAB9A
SCHEMBL6089761 0.84 GPR132 (0.49) PTGER4SLC26A4NR4A2NPC1RAB9A
SCHEMBL6088808 0.82 SLC26A4 (0.46) PTGER4SLC26A4NR4A2NPC1RAB9A
SCHEMBL6088674 0.82 SLC26A4 (0.63) PTGER4SLC26A4NR4A2NPC1RAB9A
SCHEMBL6088614 0.81 CYSLTR1 (0.50) SLC26A4NR4A2NPC1RAB9AGPBAR1
SCHEMBL5725146 0.80 CYSLTR1 (0.67) GPBAR1CYSLTR1
SCHEMBL4450804 0.80 PPARA (0.55) PTGER4SLC26A4FFAR1
SCHEMBL5724957 0.80 PPARA (0.55) PTGER4NPC1RAB9A

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-7005440-B1 Therapeutic uses of tri-aryl acid derivatives AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2006-02-28 US disclosed
CN-1183113-C Tri-aryl acid derivatives as PPAR receptor ligands ���ĵ�˹ҩ��¹����޹�˾ 2005-01-05 CN disclosed
CN-1356983-A Tri-aryl acid derivatives as PPAR receptor ligands AVENTIS PHARM PROD INC (DE) 2002-07-03 CN disclosed