SCHEMBL7920667

SCHEMBL7920667

COC(=O)C(Cc1ccc(OCCNCc2nc3ccccc3o2)cc1)=[N+]=[N-]

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 8/20 0.42
▸ P2RY14 Q15391 2/20 0.42
▸ DRD4 P21917 1/20 0.38
▸ LTA4H P09960 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ PPARA Q07869 1/20 0.36
▸ SLC40A1 Q9NP59 1/20 0.36

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
SCHEMBL7922696 0.80 PPARG (0.64) PPARGDRD4LTA4HALDH1A1RAB9A
SCHEMBL7815659 0.80 PPARG (0.67) PPARGPPARA
SCHEMBL9005930 0.79 ALDH1A1 (0.50) PPARGDRD4ALDH1A1KMT2ALMNA
SCHEMBL9005904 0.78 DRD4 (0.46) PPARGDRD4KMT2ANPC1LMNA
SCHEMBL7926603 0.78 PPARG (0.50) PPARGPPARA
SCHEMBL7920692 0.78 PPARG (0.50) PPARGLTA4HKMT2APPARA
SCHEMBL9005955 0.77 ALOX5 (0.47) PPARGP2RY14DRD4LTA4HKMT2A
SCHEMBL2786491 0.76 PPARG (0.53) PPARGDRD4PPARA
SCHEMBL9160316 0.76 PPARG (0.42) PPARGP2RY14DRD4KMT2ALMNA
SCHEMBL7922719 0.76 PPARG (0.48) PPARGDRD4PPARA

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
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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