SCHEMBL5331403

SCHEMBL5331403

CC(=O)c1cccc(OC(C)(C)C(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 8/20 0.53
▸ PPARG P37231 7/20 0.52
▸ PPARA Q07869 6/20 0.52
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ CYP1A2 P05177 2/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ PTPN7 P35236 1/20 0.48
▸ DUSP3 P51452 1/20 0.48
▸ PTPN12 Q05209 1/20 0.48
▸ PTPN22 Q9Y2R2 1/20 0.48
▸ NPC1 O15118 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ FABP2 P12104 1/20 0.46
▸ SLC22A12 Q96S37 1/20 0.46
▸ MAOA P21397 2/20 0.46

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
SCHEMBL12327872 0.88 AKR1C3 (0.56) PPARGPPARAMEN1KMT2ACYP1A2
SCHEMBL11401778 0.85 PPARG (0.58) PPARGPPARAMEN1KMT2ACYP1A2
SCHEMBL2037979 0.84 KMT2A (0.54) MAOBMEN1KMT2ACYP1A2NPC1
SCHEMBL2436356 0.84 PPARA (0.50) PPARGPPARAMEN1KMT2ACYP1A2
SCHEMBL15445175 0.82 PPARA (0.50) PPARGPPARAMEN1KMT2ACYP1A2
SCHEMBL2557596 0.82 MAOB (0.51) MAOBMEN1KMT2ACYP1A2MAPT
SCHEMBL2558100 0.81 MAOB (0.51) MAOBPPARGPPARAMEN1KMT2A
SCHEMBL3845579 0.81 PPARG (0.56) PPARGPPARAMEN1KMT2ACYP1A2
SCHEMBL11399949 0.80 PPARG (0.57) PPARGPPARAALDH1A1FABP2SLC22A12
SCHEMBL11377777 0.80 PPARG (0.58) MAOBPPARGPPARAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 — — US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 — — EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 — — EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 — — US disclosed
WO-2007118964-A1 SUBSTITUTED N-(PHENETHYL)BENZAMIDE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-10-25 — — WO disclosed
US-5310757-A Hypolipemic, hypocholesterol PANMEDICA (FR) 1994-05-10 — — US disclosed
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