SCHEMBL2743840

SCHEMBL2743840

O=S(=O)(O)CCCN1CCCc2ccc(O)cc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 6/20 0.54
CHRM4 P08173 5/20 0.54
TRPV1 Q8NER1 1/20 0.46
DRD2 P14416 5/20 0.40
DRD4 P21917 5/20 0.40
DRD3 P35462 5/20 0.40
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
GFER P55789 1/20 0.38
DRD1 P21728 5/20 0.38
DRD5 P21918 5/20 0.38
TYMS P04818 1/20 0.38
CHRM1 P11229 4/20 0.38
CHRM3 P20309 4/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
RORC P51449 1/20 0.36

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
SCHEMBL2743717 0.92 CHRM2 (0.47) CHRM2CHRM4TRPV1DRD2DRD4
SCHEMBL2743718 0.92 CHRM2 (0.47) CHRM2CHRM4TRPV1DRD2DRD4
SCHEMBL1428735 0.83 RORC (0.51) DRD2DRD4DRD3DRD1DRD5
SCHEMBL917255 0.82 DRD2 (0.57) CHRM2CHRM4DRD2DRD4DRD3
SCHEMBL1394587 0.82 RORC (0.50) DRD2DRD4DRD3DRD1DRD5
SCHEMBL30323644 0.81 CHRM2 (0.46) CHRM2CHRM4TRPV1DRD2DRD4
SCHEMBL9816060 0.78 HDAC1 (0.47) CHRM2CHRM4DRD2DRD4DRD3
SCHEMBL19365230 0.78 CHRM2 (0.53) CHRM2CHRM4TRPV1DRD2DRD4
SCHEMBL10411259 0.78 HDAC1 (0.49) CHRM2CHRM4DRD2DRD4DRD3
SCHEMBL4503966 0.77 CHRM2 (0.58) CHRM2CHRM4TRPV1DRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE49362-E1 Dye compounds and the use of their labelled conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2023-01-10 US disclosed
US-RE49362-E1 Dye compounds and the use of their labelled conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2023-01-10 US disclosed
EP-2021415-B1 DYE COMPOUNDS AND THE USE OF THEIR LABELLED CONJUGATES ILLUMINA CAMBRIDGE LTD (GB) 2017-03-15 EP disclosed
EP-2021415-B1 DYE COMPOUNDS AND THE USE OF THEIR LABELLED CONJUGATES ILLUMINA CAMBRIDGE LTD (GB) 2017-03-15 EP disclosed
US-8178360-B2 Dye compounds and the use of their labelled conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2012-05-15 US disclosed
US-8178360-B2 Dye compounds and the use of their labelled conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2012-05-15 US disclosed
US-8178360-B2 Dye compounds and the use of their labelled conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2012-05-15 US disclosed
US-20100009353-A1 Dye Compounds and the Use of their Labelled Conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2010-01-14 US disclosed
US-20100009353-A1 Dye Compounds and the Use of their Labelled Conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2010-01-14 US disclosed
US-20100009353-A1 Dye Compounds and the Use of their Labelled Conjugates ILLUMINA CAMBRIDGE LIMITED (GB) 2010-01-14 US disclosed
WO-2007135368-A2 DYE COMPOUNDS AND THE USE OF THEIR LABELLED CONJUGATES SOLEXA LIMITED (GB) 2007-11-29 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-20100009353-A1 Dye Compounds and the Use of their Labelled Conjugates HNRNPH3, DDB1, CD99 CHRM2 4670/4885CHRM4 4183/4885TRPV1 4707/4885

“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.