SCHEMBL6178916

SCHEMBL6178916

CC(C)(Oc1cccc(N)c1)C(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.52
▸ PPARA Q07869 5/20 0.50
▸ PPARG P37231 5/20 0.50
▸ ALDH1A1 P00352 2/20 0.43
▸ FBP1 P09467 1/20 0.42
▸ APP P05067 1/20 0.40
▸ NR4A2 P43354 1/20 0.40
▸ PPARD Q03181 1/20 0.39
▸ F2 P00734 1/20 0.39
▸ PLAU P00749 1/20 0.39
▸ PLAT P00750 1/20 0.39

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
SCHEMBL655568 0.83 PPARA (0.61) PPARAPPARGALDH1A1FBP1
SCHEMBL2668319 0.78 PPARA (0.54) MAOBPPARAPPARGALDH1A1PPARD
SCHEMBL6081371 0.78 PPARA (0.61) PPARAPPARGALDH1A1FBP1
SCHEMBL14943944 0.77 CYP3A4 (0.44) MAOBPPARAPPARGALDH1A1FBP1
SCHEMBL6180358 0.77 MGLL (0.50) PPARAPPARGPPARD
SCHEMBL11431131 0.77 PPARA (0.62) MAOBPPARAPPARGALDH1A1
SCHEMBL2822423 0.77 NR4A2 (0.56) MAOBPPARAPPARGALDH1A1NR4A2
SCHEMBL13039762 0.76 THRA (0.43) MAOBALDH1A1
SCHEMBL15271467 0.75 CYP3A4 (0.48) MAOBPPARAPPARGALDH1A1
SCHEMBL7358718 0.75 PPARA (0.52) PPARAPPARGALDH1A1FBP1

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-0945445-B9 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARM CO LTD (JP) 2005-12-28 — — EP disclosed
EP-0945445-B1 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARM CO LTD (JP) 2003-09-03 — — EP disclosed
US-6239131-B1 WHICH HAVE GASTRIN AND/OR CCK-B (CHOLECYSTOKININ-B) RECEPTOR ANTAGONISM, USEFUL AS REMEDIES FOR GASTRIC ULCER AND GASTROINTESTINAL MOVEMENT DISORDER. ZERIA PHARMACEUTICAL CO., LTD. (JP) 2001-05-29 — — US disclosed
EP-0945445-A1 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 — — EP disclosed
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