SCHEMBL2743718

SCHEMBL2743718

CCN(CC)CC.O=S(=O)(O)CCCN1CCCc2ccc(O)cc21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.47
CHRM4 P08173 1/20 0.47
TRPV1 Q8NER1 1/20 0.41
NLRP3 Q96P20 1/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
RORC P51449 9/20 0.37
HRH3 Q9Y5N1 1/20 0.36
REN P00797 2/20 0.36
DRD2 P14416 2/20 0.36
DRD4 P21917 2/20 0.36
DRD3 P35462 2/20 0.36
DRD1 P21728 1/20 0.36
DRD5 P21918 1/20 0.36
CYP3A4 P08684 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
SCHEMBL2743717 1.00 CHRM2 (0.47) CHRM2CHRM4TRPV1NLRP3MEN1
SCHEMBL2743840 0.92 CHRM2 (0.54) CHRM2CHRM4TRPV1MEN1ALDH1A1
SCHEMBL30323644 0.78 CHRM2 (0.46) CHRM2CHRM4TRPV1MEN1ALDH1A1
SCHEMBL1428735 0.78 RORC (0.51) RORCHRH3DRD2DRD4DRD3
SCHEMBL2754109 0.78 MEN1 (0.38) MEN1ALDH1A1KMT2ARORCHRH3
SCHEMBL30323705 0.78 MEN1 (0.38) MEN1ALDH1A1KMT2ARORCHRH3
SCHEMBL1394587 0.77 RORC (0.50) RORCHRH3DRD2DRD4DRD3
SCHEMBL917255 0.76 DRD2 (0.57) CHRM2CHRM4MEN1ALDH1A1KMT2A
SCHEMBL4400467 0.73 CHRM2 (0.61) CHRM2CHRM4TRPV1MEN1ALDH1A1
SCHEMBL6684778 0.73 CHRM2 (0.52) CHRM2CHRM4TRPV1HRH3REN

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 5 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-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
EP-2021415-A2 DYE COMPOUNDS AND THE USE OF THEIR LABELLED CONJUGATES Solexa Limited (GB) 2009-02-11 EP 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.