SCHEMBL1833919

SCHEMBL1833919

CCc1cc2ccccc2c(O)c1O

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.49
GABRA1 P14867 1/20 0.45
GABRB2 P47870 1/20 0.45
NQO1 P15559 1/20 0.43
GPR84 Q9NQS5 1/20 0.43
ATM Q13315 1/20 0.42
POLB P06746 1/20 0.42
GPR35 Q9HC97 1/20 0.42
PTPN22 Q9Y2R2 1/20 0.42
TRPM4 Q8TD43 1/20 0.42
ME2 P23368 1/20 0.42
ME1 P48163 1/20 0.42
ME3 Q16798 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 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
SCHEMBL16983223 0.86 GPR84 (0.49) CASP6GABRA1GABRB2NQO1GPR84
SCHEMBL28712363 0.85 GABRA1 (0.42) CASP6GABRA1GABRB2GPR84ATM
SCHEMBL3954044 0.85 POLB (0.47) CASP6GABRA1GABRB2GPR84ATM
SCHEMBL3957770 0.85 POLB (0.44) CASP6GABRA1GABRB2NQO1GPR84
SCHEMBL10337667 0.85 TRPM4 (0.44) CASP6GABRA1GABRB2NQO1GPR84
SCHEMBL17329242 0.85 GPR84 (0.51) CASP6GPR84ATMPTPN22TRPM4
SCHEMBL6545119 0.82 TLR8 (0.47) CASP6GPR84
SCHEMBL12972497 0.82 ME2 (0.62) POLBGPR35ME2ME1ME3
Propane SCHEMBL243407 0.81 PTPN22 (0.50) CASP6NQO1POLBGPR35PTPN22
SCHEMBL10933263 0.80 TLR8 (0.49) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11129779-B2 Thickening system in a percarbonate-containing blonding agent Henkel IP & Holding GmbH (DE) 2021-09-28 US disclosed
US-10723690-B2 (Meth)acryloyl compound and method for producing same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2020-07-28 US disclosed
US-20200206100-A1 THICKENING SYSTEM IN A PERCARBONATE-CONTAINING BLONDING AGENT HENKEL AG & CO. KGAA (DE) 2020-07-02 US disclosed
US-20180210341-A1 NOVEL (METH)ACRYLOYL COMPOUND AND METHOD FOR PRODUCING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2018-07-26 US disclosed
EP-3326997-A1 NEW (METH)ACRYLOYL COMPOUND AND PRODUCTION METHOD FOR SAME Mitsubishi Gas Chemical Company, Inc. (JP) 2018-05-30 EP disclosed
CN-104968637-B Allyl compound and its manufacture method 三菱瓦斯化学株式会社 2017-12-26 CN disclosed
EP-2955169-B1 NOVEL ALLYL COMPOUND AND METHOD FOR PRODUCING THE SAME MITSUBISHI GAS CHEMICAL CO (JP) 2017-03-15 EP disclosed
US-9464068-B2 Allyl compound and method for producing the same MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-10-11 US disclosed
US-20150368224-A1 NOVEL ALLYL COMPOUND AND METHOD FOR PRODUCING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2015-12-24 US disclosed
EP-2955169-A1 NOVEL ARYL COMPOUND AND METHOD FOR PRODUCING SAME Mitsubishi Gas Chemical Company, Inc. (JP) 2015-12-16 EP disclosed
EP-2320868-A2 HAIR PREPARATION COMPRISING SPIRULINA EXTRACT Henkel AG & Co. KGaA (DE) 2011-05-18 EP disclosed
WO-2010029005-A2 HAIR PREPARATION COMPRISING SPIRULINA EXTRACT HENKEL AG & CO. KGAA (DE) 2010-03-18 WO disclosed
US-20090117346-A1 PHOTOSENSITIVE MATERIAL FOR FORMING CONDUCTIVE FILM, CONDUCTIVE FILM, LIGHT TRANSMITTING ELECTROMAGNETIC WAVE SHIELDING FILM AND METHOD FOR MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2009-05-07 US disclosed
US-20090117346-A1 PHOTOSENSITIVE MATERIAL FOR FORMING CONDUCTIVE FILM, CONDUCTIVE FILM, LIGHT TRANSMITTING ELECTROMAGNETIC WAVE SHIELDING FILM AND METHOD FOR MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2009-05-07 US disclosed
US-20090098480-A1 PHOTOSENSITIVE MATERIAL FOR FORMING CONDUCTIVE FILM, CONDUCTIVE FILM, LIGHT TRANSMITTING ELECTROMAGNETIC WAVE SHIELDING FILM AND METHOD FOR MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2009-04-16 US disclosed
US-20090098480-A1 PHOTOSENSITIVE MATERIAL FOR FORMING CONDUCTIVE FILM, CONDUCTIVE FILM, LIGHT TRANSMITTING ELECTROMAGNETIC WAVE SHIELDING FILM AND METHOD FOR MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2009-04-16 US disclosed
US-20090029125-A1 PHOTOSENSITIVE MATERIAL FOR FORMING CONDUCTIVE FILM, CONDUCTIVE FILM, LIGHT TRANSMITTING ELECTROMAGNETIC WAVE SHIELDING FILM AND METHOD FOR MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2009-01-29 US disclosed
US-20090029125-A1 PHOTOSENSITIVE MATERIAL FOR FORMING CONDUCTIVE FILM, CONDUCTIVE FILM, LIGHT TRANSMITTING ELECTROMAGNETIC WAVE SHIELDING FILM AND METHOD FOR MANUFACTURING THE SAME FUJIFILM CORPORATION (JP) 2009-01-29 US 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 (5 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-20180210341-A1 NOVEL (METH)ACRYLOYL COMPOUND AND METHOD FOR PRODUCING SAME MTR, MRM1, MT-CO1 CASP6 3068/4885GABRA1 2739/4885GABRB2 3234/4885
US-20150368224-A1 NOVEL ALLYL COMPOUND AND METHOD FOR PRODUCING THE SAME CBR1, CYP11B1, CYP11B2 CASP6 4182/4885GABRA1 788/4885GABRB2 1357/4885
US-11129779-B2 Thickening system in a percarbonate-containing blonding agent KRT18, DSG1, POLR1C CASP6 2552/4885GABRA1 3062/4885GABRB2 2704/4885
US-10723690-B2 (Meth)acryloyl compound and method for producing same MTR, MRM1, MT-CO1 CASP6 2534/4885GABRA1 2390/4885GABRB2 3139/4885
US-20200206100-A1 THICKENING SYSTEM IN A PERCARBONATE-CONTAINING BLONDING AGENT KRT18, DSG1, POLR1C CASP6 2552/4885GABRA1 3062/4885GABRB2 2704/4885

“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.