SCHEMBL17021897

SCHEMBL17021897

CCCCOC[C@H](NC(=O)OC(C)(C)C)c1nnn(CC)n1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 14/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.36
CTSK P43235 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
SCHEMBL17021889 0.88 TSHR (0.40) GHSRTSHRALDH1A1L3MBTL1LMNA
SCHEMBL17021876 0.88 TSHR (0.41) GHSRTSHRALDH1A1L3MBTL1LMNA
SCHEMBL17018571 0.83 MAPK1 (0.42) GHSRTSHRALDH1A1L3MBTL1CTSK
SCHEMBL17021900 0.78 PLA2G2C (0.43) TSHRALDH1A1L3MBTL1LMNACTSK
SCHEMBL17021888 0.77 TSHR (0.41) GHSRTSHRALDH1A1L3MBTL1LMNA
SCHEMBL24058755 0.72 TSHR (0.38) TSHRALDH1A1L3MBTL1LMNACTSK
SCHEMBL20057137 0.72 TSHR (0.38) TSHRALDH1A1L3MBTL1LMNACTSK
SCHEMBL16561772 0.72 TSHR (0.53) TSHRALDH1A1L3MBTL1LMNACTSK
SCHEMBL20057384 0.72 TSHR (0.37) TSHRALDH1A1L3MBTL1LMNACTSK
SCHEMBL16774850 0.71 PLA2G2C (0.49) CTSK

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
US-9278968-B2 Imidazopyridine compounds ASTELLAS PHARMA INC. (JP) 2016-03-08 US disclosed
US-20150232464-A1 IMIDAZOPYRIDINE COMPOUNDS ASTELLAS PHARMA INC. (JP) 2015-08-20 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-20150232464-A1 IMIDAZOPYRIDINE COMPOUNDS PRKG1, PDE3B, PDE3A GHSR 1729/4885TSHR 4263/4885ALDH1A1 2391/4885

“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.