SCHEMBL3705344

SCHEMBL3705344

CC(C)(C)C(SCc1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.47
PPARA Q07869 2/20 0.47
EPHX1 P07099 4/20 0.46
L3MBTL1 Q9Y468 2/20 0.42
ATM Q13315 1/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
PRMT1 Q99873 1/20 0.41
CYP2C19 P33261 1/20 0.41
ACE P12821 1/20 0.40

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
SCHEMBL4804696 0.86 BLM (0.44) EPHX1POLBSMN1; SMN2CYP2C19
SCHEMBL27978025 0.82 PPARG (0.43) PPARGPPARAEPHX1L3MBTL1ATM
SCHEMBL6954426 0.79 PPARG (0.49) PPARGPPARAEPHX1L3MBTL1ATM
SCHEMBL11169156 0.77 PPARG (0.40) PPARGPPARAEPHX1L3MBTL1ATM
SCHEMBL9795681 0.77 PPARG (0.43) PPARGPPARAEPHX1L3MBTL1ATM
SCHEMBL6991601 0.76 EPHX1 (0.53) PPARGPPARAEPHX1L3MBTL1ATM
SCHEMBL27689415 0.76 TSHR (0.47) PPARGL3MBTL1POLBSMN1; SMN2CYP3A4
SCHEMBL24977618 0.76 PPARG (0.46) PPARGPPARAEPHX1L3MBTL1ATM
SCHEMBL44800 0.76 L3MBTL1 (0.56) PPARGPPARAEPHX1L3MBTL1ATM
SCHEMBL9741106 0.74 PPARG (0.46) PPARGPPARAEPHX1L3MBTL1ATM

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
EP-3947540-B1 METHOD FOR STABILIZING THERMOPLASTIC RECYCLATES, STABILIZED PLASTIC COMPOSITIONS, AND MOLDING COMPOUNDS AND MOLDED PARTS PRODUCED THEREFROM FRAUNHOFER GES FORSCHUNG (DE) 2023-08-16 EP disclosed
EP-4017938-A1 A PROCESS FOR THE PRODUCTION OF FINGERPRINT TEXTURE FREE LIQUID CRYSTAL FILMS BASF SE (DE) 2022-06-29 EP disclosed
WO-2021032518-A1 A PROCESS FOR THE PRODUCTION OF FINGERPRINT TEXTURE FREE LIQUID CRYSTAL FILMS BASF SE (DE) 2021-02-25 WO disclosed
EP-2396395-A1 N-ACYLSARCOSINE COMPOSITIONS BASF SE (DE) 2011-12-21 EP disclosed
WO-2010092010-A1 N-ACYLSARCOSINE COMPOSITIONS BASF SE (DE) 2010-08-19 WO disclosed
EP-0981530-A1 COMPOUNDS ON THE BASIS OF POLYALKYL-1-OXA-DIAZASPIRODECANE COMPOUNDS Clariant GmbH (DE) 2000-03-01 EP disclosed
WO-1998051690-A1 COMPOUNDS ON THE BASIS OF POLYALKYL-1-OXA-DIAZASPIRODECANE COMPOUNDS CLARIANT GMBH (DE) 1998-11-19 WO disclosed