SCHEMBL1610697

SCHEMBL1610697

[CH2]CCCc1c2ccccc2cc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 7/20 0.38
HSD17B10 Q99714 5/20 0.38
HIF1A Q16665 1/20 0.38
CYP1B1 Q16678 1/20 0.38
CYP1A2 P05177 5/20 0.38
CYP2A6 P11509 2/20 0.38
HPGD P15428 4/20 0.37
KDM4E B2RXH2 4/20 0.36
CYP2C19 P33261 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GLA P06280 1/20 0.36
POLB P06746 2/20 0.36
GPR35 Q9HC97 2/20 0.36
CYP3A4 P08684 1/20 0.35
ERBB2 P04626 1/20 0.35
FYN P06241 1/20 0.35
MAOA P21397 1/20 0.35

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
SCHEMBL1610561 0.94 HTR2A (0.50) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A
SCHEMBL1611369 0.92 HTR2A (0.48) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A
SCHEMBL1610938 0.92 HTR2A (0.48) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A
SCHEMBL1610101 0.92 HTR2A (0.48) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A
SCHEMBL1613224 0.87 HTR2A (0.56) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A
SCHEMBL7875750 0.87 HTR2A (0.60) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A
SCHEMBL7877776 0.87 HTR2A (0.60) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A
SCHEMBL7877797 0.85 HTR2A (0.58) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A
SCHEMBL7874386 0.85 HTR2A (0.58) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A
SCHEMBL9445712 0.82 HTR2A (0.65) HTR2AL3MBTL1ALDH1A1HSD17B10HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3020715-B1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2021-06-16 EP disclosed
CN-109071960-B Silicon-containing heterocyclic matting agents, compounds and polymers 富士胶片和光纯药株式会社 2021-01-12 CN disclosed
CN-108473784-B Polyfunctional polymerizable compound and coloring composition 富士胶片和光纯药株式会社 2021-01-12 CN disclosed
EP-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed
CN-111465662-A Aqueous dispersions of pigmented particles 三菱铅笔株式会社 2020-07-28 CN disclosed
CN-111218126-A Matting agent, compound and polymer 富士胶片和光纯药株式会社 2020-06-02 CN disclosed
EP-2990404-B1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL CO (JP) 2020-05-27 EP disclosed
CN-107001807-B Compound and polymer 富士胶片和光纯药株式会社 2020-04-03 CN disclosed
CN-105492432-B Tetrazolinone compound and use thereof 住友化学株式会社 2019-06-14 CN disclosed
CN-109071960-A Silicon-containing heterocyclic compound and matting agent 富士胶片和光纯药株式会社 2018-12-21 CN disclosed
EP-2841429-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES Sumitomo Chemical Company Limited (JP) 2015-03-04 EP disclosed
EP-2841433-A1 TETRAZOLINONE COMPOUNDS AND ITS USE Sumitomo Chemical Company Limited (JP) 2015-03-04 EP disclosed
US-20150051171-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-02-19 US disclosed
US-20150031733-A1 TETRAZOLINONE COMPOUNDS AND ITS USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-01-29 US disclosed
CN-104271571-A Tetrazolinone compound and use thereof SUMITOMO CHEMICAL CO 2015-01-07 CN disclosed
CN-104245689-A Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL CO 2014-12-24 CN disclosed
WO-2013162077-A1 TETRAZOLINONE COMPOUNDS AND ITS USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-10-31 WO disclosed
WO-2013162072-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-10-31 WO disclosed
US-20110087034-A1 Organic Semiconductor Material SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-04-14 US disclosed
EP-2248818-A1 ORGANIC SEMICONDUCTOR MATERIAL Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP 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 (3 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-20150031733-A1 TETRAZOLINONE COMPOUNDS AND ITS USE CBR3, CYP51A1, CYP8B1 HTR2A 3483/4885L3MBTL1 799/4885ALDH1A1 1716/4885
US-20150051171-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES CBR3, CYCS, CBR1 HTR2A 3482/4885L3MBTL1 238/4885ALDH1A1 1594/4885
US-20110087034-A1 Organic Semiconductor Material OR10J3, TST, OR51E2 HTR2A 599/4885L3MBTL1 236/4885ALDH1A1 137/4885

“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.