SCHEMBL66876

SCHEMBL66876

CC1CC(=O)c2ccccc2C1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 8/20 0.64
S100A4 P26447 2/20 0.59
CSNK2A2 P19784 1/20 0.46
CSNK2A1 P68400 1/20 0.46
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
HTR2B P41595 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
AR P10275 1/20 0.39
CYP19A1 P11511 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL20924856 0.79 ACHE (0.59) ACHES100A4LMNATP53CYP1A2
SCHEMBL9372008 0.78 ACHE (0.48) ACHES100A4CSNK2A2CSNK2A1TSHR
SCHEMBL181579 0.78 ACHE (0.48) ACHES100A4CSNK2A2CSNK2A1TSHR
SCHEMBL31326549 0.78 ACHE (0.48) ACHES100A4CSNK2A2CSNK2A1TSHR
SCHEMBL9752693 0.78 ACHE (1.00) ACHETSHRCYP19A1
SCHEMBL9367273 0.78 ACHE (0.48) ACHES100A4CSNK2A2CSNK2A1TSHR
SCHEMBL4938272 0.78 ACHE (1.00) ACHETSHRCYP19A1
SCHEMBL20368206 0.78 ACHE (0.48) ACHES100A4CSNK2A2CSNK2A1TSHR
SCHEMBL354925 0.78 ACHE (1.00) ACHETSHRCYP19A1
SCHEMBL13866434 0.78 ACHE (1.00) ACHETSHRCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115582131-B Copper-manganese catalyst and preparation method and application thereof 浙江新和成股份有限公司 2023-12-19 CN claimed
CN-113862034-B Method for synthesizing high-density aviation kerosene from biomass diene and p-benzoquinone in one pot 中国科学院大连化学物理研究所 2023-11-07 CN claimed
CN-116462588-A Preparation method of vitamin K4 浙江新和成药业有限公司 2023-07-21 CN claimed
CN-111689844-B Novel production process of 2-methyl-1, 4-naphthoquinone 能特科技有限公司 2023-06-13 CN claimed
CN-116102413-A Preparation method of 2-methyl-1, 4-naphthoquinone and intermediate thereof 浙江大学 2023-05-12 CN claimed
CN-116102414-A Preparation method of benzoquinone compound and 2-methyl-1, 4-naphthoquinone 浙江大学 2023-05-12 CN claimed
CN-115805096-B Heterogeneous nitrogen-doped carbon material supported cobalt catalyst and vitamin K 3 Is produced by the production process of (2) 浙江新和成股份有限公司 2023-05-12 CN claimed
CN-115805096-A Heterogeneous nitrogen-doped carbon material supported cobalt catalyst and vitamin K 3 Production process of 浙江新和成股份有限公司 2023-03-17 CN claimed
CN-115582131-A Copper-manganese catalyst and preparation method and application thereof 浙江新和成股份有限公司 2023-01-10 CN claimed
CN-111689844-A Novel production process of 2-methyl-1, 4-naphthoquinone 能特科技有限公司 2020-09-22 CN claimed
CN-117865787-A Crystal form I of menatetrenone and preparation method thereof 郑州泰丰制药有限公司 2024-04-12 CN disclosed
CN-115582131-B Copper-manganese catalyst and preparation method and application thereof 浙江新和成股份有限公司 2023-12-19 CN disclosed
CN-113862034-B Method for synthesizing high-density aviation kerosene from biomass diene and p-benzoquinone in one pot 中国科学院大连化学物理研究所 2023-11-07 CN disclosed
CN-116462588-A Preparation method of vitamin K4 浙江新和成药业有限公司 2023-07-21 CN disclosed
CN-116462588-A Preparation method of vitamin K4 浙江新和成药业有限公司 2023-07-21 CN disclosed
US-20090264563-A1 USE OF A SPECIFIC PLATINUM COMPOUND IN ORDER TO IMPROVE THE RESISTANCE OF SILICON ELASTOMERS TO DEGREDATION CAUSED BY VERY HIGH TEMPERATURES RHONDA CHIME (FR) 2009-10-22 US disclosed
US-7202320-B2 Silicone composition crosslinkable into elastomer by hydrosilylation, in the presence of carbene-based metal catalysts, and catalysts RHODIA CHIMIE (FR) 2007-04-10 US disclosed
US-7202320-B2 Silicone composition crosslinkable into elastomer by hydrosilylation, in the presence of carbene-based metal catalysts, and catalysts RHODIA CHIMIE (FR) 2007-04-10 US disclosed
EP-0866692-A1 USE OF BICYCLIC MONO- OR DIKETONE DERIVATIVES, RESULTING COMPOUNDS, AND USE THEREOF AS A DRUG FOR TREATING INFLAMMATION, MIGRAINE AND SHOCK LABORATOIRE INNOTHERA Société Anonyme (FR) 1998-09-30 EP disclosed
WO-1997021432-A1 USE OF BICYCLIC MONO- OR DIKETONE DERIVATIVES, RESULTING COMPOUNDS, AND USE THEREOF AS A DRUG FOR TREATING INFLAMMATION, MIGRAINE AND SHOCK LABORATOIRE INNOTHERA, S.A. (FR) 1997-06-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090264563-A1 USE OF A SPECIFIC PLATINUM COMPOUND IN ORDER TO IMPROVE THE RESISTANCE OF SILICON ELASTOMERS TO DEGREDATION CAUSED BY VERY HIGH TEMPERATURES XRCC5, PPOX, GPX4 ACHE 2079/4885S100A4 3456/4885CSNK2A2 3249/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.