SCHEMBL6258634

SCHEMBL6258634

CC(=O)O[C@H](Cc1ccc(C)cc1)c1cc2cc(-c3cccc(C)c3)ccc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.41
▸ PPARA Q07869 1/20 0.41
▸ MME P08473 1/20 0.41
▸ ABCB1 P08183 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ FFAR1 O14842 4/20 0.38
▸ ICMT O60725 1/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ MMP2 P08253 1/20 0.36
▸ MMP13 P45452 1/20 0.36
▸ MMP14 P50281 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ BCL2 P10415 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL6209294 0.84 NPC1 (0.40) PPARGPPARAMMEABCB1KDM4E
SCHEMBL6239362 0.76 JAK2 (0.42) MMEABCB1KDM4EFFAR1KMT2A
SCHEMBL5093602 0.74 KDM4E (0.52) PPARGPPARAABCB1KDM4EALDH1A1
SCHEMBL5097282 0.69 LOXL2 (0.47) ABCB1KDM4EALDH1A1HSD17B10ICMT
SCHEMBL30722993 0.65 PPARG (0.59) PPARGPPARAMME
SCHEMBL539481 0.65 PPARG (0.52) PPARGPPARAMMEALDH1A1FFAR1
SCHEMBL8227652 0.64 MME (0.53) PPARGPPARAMMEFFAR1MMP2
SCHEMBL6212593 0.64 RAB9A (0.44) ABCB1KDM4EALDH1A1HSD17B10ICMT
Hydrochloric Acid SCHEMBL539480 0.64 PPARG (0.51) PPARGPPARAMMEALDH1A1
Hydrochloric Acid SCHEMBL539482 0.64 PPARG (0.51) PPARGPPARAMMEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569639-A2 SUBSTITUTED DIHYDROPYRANO INDOLE-3,4-DIONE DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) Wyeth (US) 2005-09-07 — — EP disclosed
WO-2004052893-A2 SUBSTITUTED DIHYDROPYRANO INDOLE-3,4-DIONE DERIVATIVES AND 3-OXOACETIC ACID SUBSTITUTED 2-HYDROXYMETHYLINDOLE DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH (US) 2004-06-24 — — WO disclosed
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