SCHEMBL21087209

SCHEMBL21087209

C#CCOCCOCCOCCOCCOCCC(N)=O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.52
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32

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
SCHEMBL19369844 1.00 TSHR (0.52) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL19369591 1.00 TSHR (0.52) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL19369592 1.00 TSHR (0.52) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL19369593 1.00 TSHR (0.52) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL19369759 1.00 TSHR (0.52) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL19369590 1.00 TSHR (0.52) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL19369842 1.00 TSHR (0.52) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL21087033 1.00 TSHR (0.52) TSHRSLC1A3SLC1A2SLC1A1
SCHEMBL352570 0.96
SCHEMBL30480105 0.90 TSHR (0.66) TSHRSLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117263948-A Compounds and conjugates thereof 免疫医疗有限公司 2023-12-22 CN claimed
US-20190175744-A1 INSULIN-INCRETIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2019-06-13 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-20190175744-A1 INSULIN-INCRETIN CONJUGATES GIPR, GLP1R, GCGR TSHR 116/4885SLC1A3 1331/4885SLC1A2 1888/4885

“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.