SCHEMBL998282

SCHEMBL998282

NNc1ccc(SC(F)(F)F)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
KDM4E B2RXH2 1/20 0.58
KIF11 P52732 1/20 0.53
PTPRZ1 P23471 4/20 0.50
PTPN1 P18031 2/20 0.50
TRPV1 Q8NER1 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
LMNA P02545 7/20 0.41
MAPT P10636 2/20 0.41
ATM Q13315 1/20 0.41
HTT P42858 2/20 0.41
GAA P10253 3/20 0.40
TP53 P04637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 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
SCHEMBL9842602 0.77 ALDH1A1 (0.52) ALDH1A1TDP1KDM4EKIF11PTPRZ1
SCHEMBL4164368 0.77 ALDH1A1 (0.52) ALDH1A1TDP1KDM4EKIF11PTPRZ1
SCHEMBL24265413 0.75 TRPV1 (0.43) ALDH1A1TDP1KDM4EKIF11PTPRZ1
SCHEMBL11123375 0.74 KIF11 (0.63) ALDH1A1TDP1KDM4EKIF11PTPRZ1
SCHEMBL5525900 0.74 KIF11 (0.63) ALDH1A1TDP1KDM4EKIF11PTPRZ1
SCHEMBL5531054 0.74 KIF11 (0.90) ALDH1A1TDP1KDM4EKIF11PTPRZ1
SCHEMBL656930 0.73 ALDH1A1 (1.00) ALDH1A1TDP1KDM4EKIF11PTPRZ1
SCHEMBL7527160 0.72 PTPRZ1 (0.50) ALDH1A1TDP1KDM4EKIF11PTPRZ1
SCHEMBL7527154 0.72 KIF11 (0.49) ALDH1A1TDP1KDM4EKIF11PTPRZ1
SCHEMBL13981960 0.72 TDP1 (0.47) ALDH1A1TDP1KDM4EKIF11PTPRZ1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101626770-A Use of TRPM5 Inhibitors for Modulating Insulin and GLP-1 Release REDPOINT BIO CORP 2010-01-13 CN claimed
EP-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed
CN-104245689-B Terazololine-one compound and its purposes as insecticide 住友化学株式会社 2017-06-06 CN disclosed
US-9565856-B2 Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-14 US disclosed
EP-2841429-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES 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
CN-104245689-A Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL CO 2014-12-24 CN disclosed
WO-2013162072-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-10-31 WO disclosed
EP-1874871-B1 WATER SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS GE HEALTHCARE UK LTD (GB) 2012-10-03 EP disclosed
EP-1874871-B1 WATER SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS GE HEALTHCARE UK LTD (GB) 2012-10-03 EP disclosed
US-20100249385-A1 WATER-SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS GE HEALTHCARE UK LIMITED (GB) 2010-09-30 US disclosed
US-20100249385-A1 WATER-SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS GE HEALTHCARE UK LIMITED (GB) 2010-09-30 US disclosed
US-20100249385-A1 WATER-SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS GE HEALTHCARE UK LIMITED (GB) 2010-09-30 US disclosed
US-7767829-B2 Water-soluble fluoro-substituted cyanine dyes as reactive fluorescence labelling reagents GE HEALTHCARE UK LIMITED (GB) 2010-08-03 US disclosed
US-7767829-B2 Water-soluble fluoro-substituted cyanine dyes as reactive fluorescence labelling reagents GE HEALTHCARE UK LIMITED (GB) 2010-08-03 US disclosed
US-7767829-B2 Water-soluble fluoro-substituted cyanine dyes as reactive fluorescence labelling reagents GE HEALTHCARE UK LIMITED (GB) 2010-08-03 US disclosed
CN-101626770-A Use of TRPM5 Inhibitors for Modulating Insulin and GLP-1 Release REDPOINT BIO CORP 2010-01-13 CN disclosed
EP-1874871-A1 WATER SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS GE Healthcare UK Limited (GB) 2008-01-09 EP disclosed
US-20060239922-A1 WATER-SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS GE HEALTHCARE UK LIMITED (GB) 2006-10-26 US disclosed
WO-2006111726-A1 WATER SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS GE HEALTHCARE UK LIMITED (GB) 2006-10-26 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 (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-20060239922-A1 WATER-SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS TPD52L2, MRPL21, MRPL9 ALDH1A1 2125/4885TDP1 3264/4885KDM4E 3025/4885
US-20100249385-A1 WATER-SOLUBLE FLUORO-SUBSTITUTED CYANINE DYES AS REACTIVE FLUORESCENCE LABELLING REAGENTS TPD52L2, MRPL9, MRPL21 ALDH1A1 2134/4885TDP1 3231/4885KDM4E 3038/4885
US-20150051171-A1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES CBR3, CYCS, CBR1 ALDH1A1 1594/4885TDP1 4060/4885KDM4E 3020/4885

“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.