SCHEMBL2788893

SCHEMBL2788893

COC(=O)C(Cc1ccc(OCc2ccccc2)cc1)Nc1ccccc1OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 7/20 0.58
▸ LTA4H P09960 1/20 0.58
▸ GPR34 Q9UPC5 2/20 0.54
▸ MME P08473 1/20 0.52
▸ ACE P12821 1/20 0.52
▸ CPA1 P15085 1/20 0.52
▸ ACE2 Q9BYF1 1/20 0.52
▸ BRD4 O60885 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ MMP9 P14780 1/20 0.51
▸ MMP8 P22894 1/20 0.51
▸ YAP1 P46937 4/20 0.50
▸ ERAP2 Q6P179 1/20 0.49
▸ LNPEP Q9UIQ6 1/20 0.49

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
SCHEMBL7708717 0.85 PPARG (0.47) PPARGLTA4HGPR34MMEACE
SCHEMBL3499757 0.83 LTA4H (0.65) PPARGLTA4HGPR34MMEACE
SCHEMBL3499760 0.83 LTA4H (0.65) PPARGLTA4HGPR34MMEACE
SCHEMBL13110180 0.83 LTA4H (0.65) PPARGLTA4HGPR34MMEACE
Hydrochloric Acid SCHEMBL29693844 0.82 LTA4H (0.64) PPARGLTA4HGPR34MMEACE
SCHEMBL6662616 0.81 PPARG (0.60) PPARGLTA4HGPR34GAARAB9A
SCHEMBL25453218 0.81 LTA4H (0.62) PPARGLTA4HGPR34MMEACE
SCHEMBL12379283 0.81 LTA4H (0.62) PPARGLTA4HGPR34MMEACE
SCHEMBL16552342 0.81 PPARG (0.69) PPARGLTA4HGPR34MMEACE
SCHEMBL2786362 0.80 YAP1 (0.56) PPARGLTA4HYAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110300129-A1 SYSTEMS AND METHODS FOR ENHANCING VACCINE EFFICACY UNIVERSITY OF ROCHESTER (US) 2011-12-08 — — US disclosed
WO-2010075037-A1 SYSTEMS AND METHODS FOR ENHANCING VACCINE EFFICACY UNIVERSITY OF ROCHESTER (US) 2010-07-01 — — WO disclosed
US-6294580-B1 FOR THERAPY AND PROPHYLAXIS OF TYPE II OR NON-INSULIN DEPENDENT DIABETES MELLITUS, HYPERGLYCAEMIA, DYSLIPIDEMIA, TYPE II DIABETES, TYPE I DIABETES, HYPERTRIGLYCERIDEMIA, SYNDROME X, INSULIN RESISTANCE, HEART FAILURE GLAXO WELLCOME INC. 2001-09-25 — — US disclosed
EP-0888317-B1 SUBSTITUTED 4-HYDROXY-PHENYLALCANOIC ACID DERIVATIVES WITH AGONIST ACTIVITY TO PPAR-GAMMA GLAXO GROUP LTD (GB) 2001-09-12 — — EP disclosed
EP-0888317-A1 SUBSTITUTED 4-HYDROXY-PHENYLALCANOIC ACID DERIVATIVES WITH AGONIST ACTIVITY TO PPAR-GAMMA GLAXO GROUP LIMITED (GB) 1999-01-07 — — EP disclosed
WO-1997031907-A1 SUBSTITUTED 4-HYDROXY-PHENYLALCANOIC ACID DERIVATIVES WITH AGONIST ACTIVITY TO PPAR-GAMMA GLAXO GROUP LIMITED (GB) 1997-09-04 — — WO disclosed
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