SCHEMBL15212674

SCHEMBL15212674

CCOC(=O)Cc1csc2cc(OCc3cc(C)nn3C)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 1/20 0.48
▸ PPARD Q03181 7/20 0.43
▸ PPARA Q07869 7/20 0.43
▸ PPARG P37231 3/20 0.43
▸ ALDH1A1 P00352 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MAOB P27338 3/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ ITGB3 P05106 1/20 0.35
▸ ITGB1 P05556 1/20 0.35
▸ ITGAV P06756 1/20 0.35
▸ ITGA5 P08648 1/20 0.35
▸ ITGB5 P18084 1/20 0.35
▸ TBXAS1 P24557 1/20 0.35

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
SCHEMBL15212691 0.90 PPARD (0.54) FFAR1PPARDPPARAPPARGALDH1A1
SCHEMBL15212694 0.88 PPARD (0.48) FFAR1PPARDPPARAPPARGALDH1A1
SCHEMBL15212693 0.80 FFAR1 (0.45) FFAR1PPARDPPARAPPARGALDH1A1
SCHEMBL17444853 0.80 PPARD (0.47) PPARDPPARAPPARGALDH1A1MAPT
SCHEMBL17431471 0.79 FFAR1 (0.49) FFAR1PPARDPPARAPPARGALDH1A1
SCHEMBL17444878 0.79 PPARD (0.46) PPARDPPARAPPARGALDH1A1MAPT
SCHEMBL15220499 0.78 PPARD (0.46) PPARDPPARAPPARGALDH1A1MAPT
SCHEMBL15211696 0.77 PPARD (0.44) PPARDPPARAPPARGALDH1A1MAPT
SCHEMBL15220437 0.77 PPARD (0.48) PPARDPPARAPPARGALDH1A1MAPT
SCHEMBL17444879 0.77 PPARD (0.47) PPARDPPARAPPARGALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2838891-B1 AROMATIC RING COMPOUND AS GHRELIN O-ACYLTRANSFERASE INHIBITOR TAKEDA PHARMACEUTICALS CO (JP) 2017-08-02 — — EP disclosed
US-9238639-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 — — US disclosed
US-9238639-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 — — US disclosed
EP-2838891-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2015-02-25 — — EP disclosed
WO-2013125732-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-08-29 — — WO disclosed
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