SCHEMBL270136

SCHEMBL270136

CCC(=O)c1ccccc1C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.45
GABRB2 P47870 2/20 0.45
ABCB1 P08183 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GABRG2 P18507 2/20 0.42
GABRB3 P28472 2/20 0.42
TSHR P16473 4/20 0.41
LMNA P02545 2/20 0.41
SLC6A2 P23975 2/20 0.41
FAAH O00519 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
GABRB1 P18505 1/20 0.41
PTGS1 P23219 1/20 0.41
HTR2C P28335 1/20 0.41

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
SCHEMBL28979450 0.87 KMT2A (0.46) GABRA1GABRB2ABCB1SMN1; SMN2MAPT
SCHEMBL13623381 0.86 GABRA1 (0.42) GABRA1GABRB2ABCB1SMN1; SMN2GABRG2
SCHEMBL4457749 0.85 GABRA1 (0.55) GABRA1GABRB2ABCB1SMN1; SMN2GABRG2
SCHEMBL1984108 0.84 HPGD (0.46) GABRA1GABRB2SMN1; SMN2MAPTL3MBTL1
SCHEMBL20063083 0.83 GABRA1 (0.47) GABRA1GABRB2SMN1; SMN2GABRG2GABRB3
SCHEMBL28724133 0.82 ABCB1 (0.42) ABCB1SMN1; SMN2MAPTL3MBTL1TSHR
SCHEMBL13990159 0.82 L3MBTL1 (0.52) ABCB1SMN1; SMN2MAPTL3MBTL1TSHR
SCHEMBL23364599 0.82 PTPN1 (0.52) GABRA1GABRB2SMN1; SMN2GABRG2GABRB3
SCHEMBL29932818 0.82 PTPN1 (0.52) GABRA1GABRB2SMN1; SMN2GABRG2GABRB3
SCHEMBL3658135 0.81 ALDH1A1 (0.49) ABCB1SMN1; SMN2MAPTL3MBTL1TSHR

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 97 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3692047-A1 HYDROLYTICALLY LABILE SILYL ENOL ETHER FRAGRANCE KETONES OR ALDEHYDES Henkel AG & Co. KGaA (DE) 2020-08-12 EP claimed
WO-2019068505-A1 HYDROLYTICALLY LABILE SILYL ENOL ETHER FRAGRANCE KETONES OR ALDEHYDES HENKEL AG & CO. KGAA (DE) 2019-04-11 WO claimed
EP-2364186-A2 PHOTOLABILE FRAGRANCE STORAGE SUBSTANCES Henkel AG & Co. KGaA (DE) 2011-09-14 EP claimed
WO-2010066486-A2 PHOTOLABILE FRAGRANCE STORAGE SUBSTANCES HENKEL AG & CO. KGAA (DE) 2010-06-17 WO claimed
EP-0731717-A1 ANTI-SMOKE PERFUMES AND COMPOSITIONS QUEST INTERNATIONAL B.V. (NL) 1996-09-18 EP claimed
WO-1995015186-A1 ANTI-SMOKE PERFUMES AND COMPOSITIONS QUEST INTERNATIONAL B.V. (NL) 1995-06-08 WO claimed
CN-117899113-A Mixed stem cell medicine for treating osteoarthritis and preparation method and application thereof 南京鼓楼医院 2024-04-19 CN disclosed
EP-4167954-A1 CHEMICALLY CROSS-LINKED ELASTOMERS FORMED BY MICHAEL ADDITION AND COMPOSITIONS COMPRISING SUCH ELASTOMERS Nanometics LLC (D.B.A. Phd Biosciences) (US) 2023-04-26 EP disclosed
EP-4149999-A1 NON-ISOCYANATE POLYURETHANE ELASTOMERS AND COMPOSITIONS COMPRISING SUCH ELASTOMERS Nanometics LLC (D.B.A. Phd Biosciences) (US) 2023-03-22 EP disclosed
EP-4107325-A1 TEXTILE TREATMENT COMPOSITION Henkel AG & Co. KGaA (DE) 2022-12-28 EP disclosed
EP-4004173-A1 MOULDED BODIES CONTAINING ACTIVE SUBSTANCES AND METHOD FOR THE PRODUCTION THEREOF Henkel AG & Co. KGaA (DE) 2022-06-01 EP disclosed
EP-4004170-A1 SHAPED PRODUCTS THAT CONTAIN AN ACTIVE SUBSTANCE AND PRODUCTION METHOD THEREOF Henkel AG & Co. KGaA (DE) 2022-06-01 EP disclosed
WO-2021257937-A1 CHEMICALLY CROSS-LINKED ELASTOMERS FORMED BY MICHAEL ADDITION AND COMPOSITIONS COMPRISING SUCH ELASTOMERS NANOMETICS LLC (D.B.A. PHD BIOSCIENCES) (US) 2021-12-23 WO disclosed
EP-1489109-A2 Living and quasiliving cationic telechelic polymers quenched by N-substituted pyrrole and methods for their preparation Chevron Oronite Company LLC (US) 2004-12-22 EP disclosed
EP-1246899-A1 PRO-PERFUME COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2002-10-09 EP disclosed
CN-1347929-A Photosensitive resin composition for producing printing board MCDEMID INC (US) 2002-05-08 CN disclosed
WO-2001051599-A1 PRO-PERFUME COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2001-07-19 WO disclosed
US-5103022-A Reacting dl-2-methyl-1-(4-trifluoromethylphenyl)-3-pyrrolidino -1-propanone with l-acetylphenylglycine to form corresponding diastereomeric salt, deposition, isolation of l-2-methyl-1-(4-trifluoromethylphenyl)-3-pyrrolidino-1-propanone NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1992-04-07 US disclosed
US-5057535-A Muscle relaxants NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1991-10-15 US disclosed
EP-0200942-A2 New derivatives of an aminoketone NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1986-11-12 EP disclosed