SCHEMBL17018541

SCHEMBL17018541

CC(=O)N[C@@H](C)c1ccccc1[C@@H](O)CO

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.42
GUCY1B2 O75343 1/20 0.41
GUCY1A2 P33402 1/20 0.41
GUCY1A1 Q02108 1/20 0.41
GUCY1B1 Q02153 1/20 0.41
MTNR1A P48039 6/20 0.41
MTNR1B P49286 6/20 0.41
ACACB O00763 4/20 0.40
ACACA Q13085 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.38

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
SCHEMBL17018544 1.00 HTT (0.42) HTTGUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL15760884 0.81 GUCY1B2 (0.40) HTTGUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL15760882 0.81 GUCY1B2 (0.40) HTTGUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL20587889 0.77 ACACB (0.43) HTTMTNR1AMTNR1BACACBACACA
SCHEMBL1549219 0.75 LMNA (0.39) L3MBTL1
SCHEMBL7723692 0.75 ALDH1A1 (0.46) HTTMTNR1AMTNR1BACACBACACA
SCHEMBL10711904 0.74 GABRA1 (0.50)
SCHEMBL19658634 0.74 L3MBTL1 (0.50) HTTACACBACACAL3MBTL1
SCHEMBL28974132 0.74 HTT (0.66) HTTMTNR1AMTNR1BACACBACACA
SCHEMBL17018471 0.74 HTT (0.66) HTTMTNR1AMTNR1BACACBACACA

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 HTT 4358/4885GUCY1B2 26/4885GUCY1A2 16/4885

“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.