SCHEMBL5204151

SCHEMBL5204151

CCCc1cc(Oc2ccc(C)cc2)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
AMY1A P0DUB6 1/20 0.42
HMGCR P04035 1/20 0.42
LPAR1 Q92633 1/20 0.41
LPAR3 Q9UBY5 1/20 0.41
IGF1R P08069 1/20 0.41
ALOX15 P16050 1/20 0.41
TEAD4 Q15561 1/20 0.40
FFAR1 O14842 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PTPN1 P18031 1/20 0.39
LTA4H P09960 2/20 0.39
LTB4R Q15722 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38

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
SCHEMBL16648400 0.91 ALOX5 (0.49) ALOX5HMGCRPTPN1LTA4HLTB4R
SCHEMBL2412893 0.87 LTA4H (0.47) ALOX5HMGCRFFAR1LTA4H
SCHEMBL5206395 0.87 HMGCR (0.50) ALOX5HMGCRIGF1RALOX15POLB
SCHEMBL2410166 0.85 PPARG (0.48) ALOX5HMGCRMAPTLTB4R
SCHEMBL3550087 0.85 AKR1B1 (0.45) ALOX5HMGCRIGF1RALOX15MAPT
SCHEMBL8637743 0.85 LTA4H (0.56) ALOX5HMGCRALOX15ALDH1A1POLB
SCHEMBL224199 0.84 AMY1A (0.57) ALOX5AMY1AHMGCRIGF1RALOX15
SCHEMBL13679030 0.83 TAAR1 (0.47) LPAR1LPAR3TEAD4FFAR1ALDH1A1
SCHEMBL8635275 0.83 PPARG (0.43) ALOX5HMGCRPOLBLTB4RLTB4R2
SCHEMBL5208689 0.83 ALOX5 (0.47) ALOX5FFAR1PTPN1LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1040102-B1 ARYLTHIAZOLIDINEDIONE DERIVATIVES MERCK & CO INC (US) 2007-01-24 EP disclosed
EP-1194146-B1 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES MERCK & CO INC (US) 2006-07-19 EP disclosed
EP-1040102-A4 ARYLTHIAZOLIDINEDIONE DERIVATIVES MERCK & CO INC (US) 2002-11-27 EP disclosed
EP-1194146-A4 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES MERCK & CO INC (US) 2002-07-31 EP disclosed
US-6399640-B1 ANTIDIABETIC AGENTS; ANTICHOLESTEROL AGENTS MERCK & CO., INC. 2002-06-04 US disclosed
EP-1194146-A1 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES Merck & Co., Inc. (US) 2002-04-10 EP disclosed
US-6200998-B1 PEROXISOME PROLIFERATOR ACTIVATED RECEPTOR AGONISTS; ANTICHOLESTEROL, ANTIDIABETIC AND ANTIOBESITY AGENTS MERCK & CO., INC. 2001-03-13 US disclosed
WO-2000078312-A1 ARYLTHIAZOLIDINEDIONE AND ARYLOXAZOLIDINEDIONE DERIVATIVES MERCK & CO., INC. (US) 2000-12-28 WO disclosed
EP-1040102-A1 ARYLTHIAZOLIDINEDIONE DERIVATIVES Merck & Co., Inc. (US) 2000-10-04 EP disclosed
US-6008237-A POTENT AGONISTS OF PEROXIDSOME PROLIFERATOR ACTIVATED RECEPTOR; FOR CONTROLLING OR PREVENTING OF DIABETES, HYPERGLYCEMIA, HYPERLIPIDEMIA, HYPERCHOLESTEROLEMIA, ATHEROSCLEROSIS, OBESITY, VASCULAR RESTENOSIS MERCK & CO., INC. (US) 1999-12-28 US disclosed
WO-1999032465-A1 ARYLTHIAZOLIDINEDIONE DERIVATIVES MERCK & CO., INC. (US) 1999-07-01 WO disclosed