SCHEMBL4950480

SCHEMBL4950480

CC(C)Cc1ccccc1C(C)C=O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.44
GABRB2 P47870 2/20 0.44
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
TSHR P16473 2/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL8228214 1.00 GABRA1 (0.44) GABRA1GABRB2CTSSCTSKMEN1
SCHEMBL1774296 0.84 GABRA1 (0.37) GABRA1GABRB2MEN1KMT2ATAAR1
SCHEMBL11346927 0.81 PNMT (0.38) MEN1KMT2ATAAR1TSHR
SCHEMBL8063305 0.79 ADRA2A (0.41) CTSSCTSKTSHR
SCHEMBL11358599 0.78 ADRA2C (0.45) GABRA1GABRB2TSHR
SCHEMBL6681972 0.77 GABRA1 (0.52) GABRA1GABRB2TSHR
SCHEMBL9184834 0.77 GABRA1 (0.52) GABRA1GABRB2TAAR1TSHR
SCHEMBL29573380 0.77 CYSLTR2 (0.44)
SCHEMBL8723703 0.77 CYSLTR2 (0.44)
SCHEMBL17749061 0.77 SRC (0.40) GABRA1GABRB2MEN1KMT2ATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160172188-A1 RINSE SOLUTION FOR SILICA THIN FILM, METHOD OF PRODUCING SILICA THIN FILM, AND SILICA THIN FILM SAMSUNG SDI CO., LTD. (KR) 2016-06-16 US claimed
EP-0672166-A1 ENANTIOSELECTIVE PRODUCTION OF CHIRAL CARBOXYLIC ACIDS SEPRACOR, INC. (US) 1995-09-20 EP claimed
WO-1994010334-A1 ENANTIOSELECTIVE PRODUCTION OF CHIRAL CARBOXYLIC ACIDS SEPRACOR, INC. (US) 1994-05-11 WO claimed
CN-105695165-A RINSE SOLUTION FOR SILICA THIN FILM, METHOD OF PRODUCING SILICA THIN FILM, AND SILICA THIN FILM 三星SDI株式会社 2016-06-22 CN disclosed
US-20160172188-A1 RINSE SOLUTION FOR SILICA THIN FILM, METHOD OF PRODUCING SILICA THIN FILM, AND SILICA THIN FILM SAMSUNG SDI CO., LTD. (KR) 2016-06-16 US disclosed
WO-2008074717-A2 PROCESS FOR THE PREPARATION OF CHIRAL 2-ARYLPROPANOLS HAVING A PROFEN-LIKE SUBSTITUTED ARYL RESIDUE ALMA MATER STUDIORUM - UNIVERSITA DI BOLOGNA (IT) 2008-06-26 WO disclosed
EP-1019352-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-07-19 EP disclosed
US-6090987-A STABILIZING A METAL-ORGANOPHOSPHORUS LIGAND COMPLEX CATALYST AGAINST DEACTIVATION BY CONDUCTING THE PORTION OF A PROCESS THAT OCCURS UNDER SEPARATION CONDITIONS IN THE PRESENCE OF ONE OR MORE ALKADIENES; ESPECIALLY HYDROFORMYLATION UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-07-18 US disclosed
EP-0876321-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-11-11 EP disclosed
EP-0876322-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-11-11 EP disclosed
EP-0874797-A1 PROCESSES EMPLOYING INDICATOR LIGANDS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-11-04 EP disclosed
WO-1997020794-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-06-12 WO disclosed
WO-1997020798-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-06-12 WO disclosed
WO-1997020799-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-06-12 WO disclosed
WO-1997016466-A1 POLYURETHANE (METH)ACRYLATES AND PROCESSES FOR PREPARING SAME UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-05-09 WO disclosed
WO-1997016401-A1 REACTION MIXTURES CONTAINING SUBSTITUTED HYDROCARBON DIOLS AND PROCESSES FOR THE PREPARATION THEREOF UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-05-09 WO disclosed
WO-1997016473-A1 POLYESTERS AND PROCESSES FOR PREPARING SAME UNION CARBIDE CHEMICALS AND PLASTICS TECHNOLOGY CORPORATION (US) 1997-05-09 WO disclosed
WO-1997014669-A1 PROCESS FOR PREPARING OPTICALLY ACTIVE CARBOXYLIC ACIDS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-04-24 WO disclosed
WO-1996034687-A1 MEMBRANE SEPARATION PROCESS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1996-11-07 WO disclosed
US-3950327-A NEW NITRONES, THEIR MANUFACTURE AND THEIR USE FOR THE MANUFACTURE OF N-SUBSTITUTED ARALIPHATIC ALDEHYDE-NITRONES CIBA-GEIGY CORPORATION (US) 1976-04-13 US disclosed