SCHEMBL15799880

SCHEMBL15799880

[N-]=[N+]=NCOC1CC(n2cc(C#CCNC(=O)COCCOC(COc3cccc(C(=O)NCCN)c3)N=[N+]=[N-])c(=O)[nH]c2=O)OC1COP(=O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.38
▸ POLA1 P09884 1/20 0.38
▸ POLD1 P28340 1/20 0.38
▸ P2RY2 P41231 1/20 0.33
▸ P2RY6 Q15077 1/20 0.33
▸ TK1 P04183 1/20 0.33

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
SCHEMBL15799931 0.98 POLB (0.39) POLBPOLA1POLD1P2RY2P2RY6
SCHEMBL18269460 0.95 TK1 (0.33) POLBPOLA1POLD1TK1
SCHEMBL16805874 0.94 POLB (0.36) POLBPOLA1POLD1TK1
SCHEMBL20088483 0.94 TK1 (0.33) POLBPOLA1POLD1TK1
SCHEMBL17636634 0.93 POLB (0.37) POLBPOLA1POLD1P2RY2P2RY6
SCHEMBL15728355 0.93 POLB (0.37) POLBPOLA1POLD1P2RY2P2RY6
SCHEMBL13891877 0.93 POLB (0.35) POLBPOLA1POLD1P2RY2P2RY6
SCHEMBL17227503 0.93 POLB (0.35) POLBPOLA1POLD1P2RY2P2RY6
SCHEMBL20094496 0.92 POLB (0.31) POLBPOLA1POLD1TK1
SCHEMBL16809142 0.92 POLB (0.32) POLBPOLA1POLD1TK1

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-9222131-B2 Rhodamine compounds and their use as fluorescent labels ILLUMINA CAMBRIDGE LIMITED 2015-12-29 — — US disclosed
US-9222131-B2 Rhodamine compounds and their use as fluorescent labels ILLUMINA CAMBRIDGE LIMITED 2015-12-29 — — US disclosed
US-8993784-B2 Polymethine compounds and their use as fluorescent labels ILLUMINA CAMBRIDGE LIMITED (GB) 2015-03-31 — — US disclosed
US-20140322713-A1 POLYMETHINE COMPOUNDS AND THEIR USE AS FLUORESCENT LABELS ILLUMINA CAMBRIDGE LIMITED (GB) 2014-10-30 — — US disclosed
US-20140255917-A1 POLYMETHINE COMPOUNDS AND THEIR USE AS FLUORESCENT LABELS ILLUMINA CAMBRIDGE LIMITED (GB) 2014-09-11 — — US disclosed
US-20140255917-A1 POLYMETHINE COMPOUNDS AND THEIR USE AS FLUORESCENT LABELS ILLUMINA CAMBRIDGE LIMITED (GB) 2014-09-11 — — US disclosed
US-20140255920-A1 RHODAMINE COMPOUNDS AND THEIR USE AS FLUORESCENT LABELS ILLUMINA CAMBRIDGE LIMITED (GB) 2014-09-11 — — US disclosed
US-20140255920-A1 RHODAMINE COMPOUNDS AND THEIR USE AS FLUORESCENT LABELS ILLUMINA CAMBRIDGE LIMITED (GB) 2014-09-11 — — US disclosed
US-8809551-B1 Polymethine compounds and their use as fluorescent labels ILLUMINA CAMBRIDGE LIMITED (GB) 2014-08-19 — — US disclosed
US-8809551-B1 Polymethine compounds and their use as fluorescent labels ILLUMINA CAMBRIDGE LIMITED (GB) 2014-08-19 — — US disclosed
US-8754244-B1 Rhodamine compounds and their use as fluorescent labels ILLUMINA CAMBRIDGE LIMITED (GB) 2014-06-17 — — 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 (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-20140322713-A1 POLYMETHINE COMPOUNDS AND THEIR USE AS FLUORESCENT LABELS POLRMT, FBL, POLM POLB 15/4885POLA1 171/4885POLD1 153/4885

“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.

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