SCHEMBL3768115

SCHEMBL3768115

C#CCCC(=O)NCCOCCOCCN

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.39
CA12 O43570 4/20 0.39
CA1 P00915 4/20 0.39
CA4 P22748 4/20 0.39
CA9 Q16790 4/20 0.39
CA14 Q9ULX7 4/20 0.39
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TLR2 O60603 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
TSHR P16473 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30
ADRB2 P07550 1/20 0.30
HTR1A P08908 1/20 0.30

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
SCHEMBL19726993 0.98 CA2 (0.37) CA2CA12CA1CA4CA9
SCHEMBL18410862 0.89 CYP1A2 (0.39) CA2CA12CA1CA4CA9
SCHEMBL19821398 0.85 CA2 (0.37) CA2CA12CA1CA4CA9
SCHEMBL23789772 0.84 TSHR (0.40) CA2CA12CA1CA4CA9
SCHEMBL3768113 0.84 CA2 (0.37) CA2CA12CA1CA4CA9
SCHEMBL16492543 0.84 TSHR (0.40) TLR2SMN1; SMN2L3MBTL1TSHR
SCHEMBL19172671 0.84 CA2 (0.49) CA2CA12CA1CA4CA9
SCHEMBL31688960 0.84 TSHR (0.39) CA2CA12CA1CA4CA9
SCHEMBL19733750 0.84 CA2 (0.36) CA2CA12CA1CA4CA9
SCHEMBL19727004 0.84 L3MBTL1 (0.40) CA2CA12CA1CA4CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210401947-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN SANOFI (FR) 2021-12-30 US disclosed
US-20210401946-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN SANOFI (FR) 2021-12-30 US disclosed
US-20210401947-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN SANOFI (FR) 2021-12-30 US disclosed
US-20210401946-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN SANOFI (FR) 2021-12-30 US disclosed
US-11090364-B2 Conjugates of a pharmaceutical agent and a moiety capable of binding to a glucose sensing protein SANOFI (FR) 2021-08-17 US disclosed
US-11090364-B2 Conjugates of a pharmaceutical agent and a moiety capable of binding to a glucose sensing protein SANOFI (FR) 2021-08-17 US disclosed
US-20190209656-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN SANOFI (FR) 2019-07-11 US disclosed
US-20190209656-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN SANOFI (FR) 2019-07-11 US disclosed
EP-3463480-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN Sanofi (FR) 2019-04-10 EP disclosed
WO-2015022335-A1 VANCOMYCIN ANALOGS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2015-02-19 WO disclosed
US-7851658-B2 Palladium-catalyzed carbon-carbon bond forming reactions PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-12-14 US disclosed
WO-2007008226-A9 PALLADIUM-CATALYZED CARBON-CARBON BOND FORMING REACTIONS HARVARD COLLEGE (US) 2007-05-24 WO disclosed
US-20070066851-A1 Palladium-catalyzed carbon-carbon bond forming reactions NAVY, SECRETARY OF THE UNITED STATES OF AMERICA 2007-03-22 US disclosed
WO-2007008226-A2 PALLADIUM-CATALYZED CARBON-CARBON BOND FORMING REACTIONS THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2007-01-18 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 (5 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-11090364-B2 Conjugates of a pharmaceutical agent and a moiety capable of binding to a glucose sensing protein GPR119, SLC2A8, SLC2A4 CA2 745/4885CA12 502/4885CA1 1797/4885
US-20070066851-A1 Palladium-catalyzed carbon-carbon bond forming reactions APEX1, PCNA, DNMT3A CA2 1417/4885CA12 1712/4885CA1 1478/4885
US-20190209656-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN GPR119, SLC2A8, SLC2A4 CA2 745/4885CA12 502/4885CA1 1797/4885
US-20210401946-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN GPR119, SLC2A8, SLC2A4 CA2 745/4885CA12 502/4885CA1 1797/4885
US-20210401947-A1 CONJUGATES OF A PHARMACEUTICAL AGENT AND A MOIETY CAPABLE OF BINDING TO A GLUCOSE SENSING PROTEIN GPR119, SLC2A8, SLC2A4 CA2 745/4885CA12 502/4885CA1 1797/4885

“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.