SCHEMBL10111911

SCHEMBL10111911

CCOc1cc(CN2CCC3(CC2)CC(=O)N(c2cc(C(=O)O)cc(C(=O)O)c2)C3)cc(OCC)c1-c1ccc(F)cc1

nearest known ligand 0.88

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 20/20 0.88
KCNH2 Q12809 3/20 0.88
PTGDR Q13258 2/20 0.88

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
SCHEMBL10128310 0.97 SSTR5 (0.85) SSTR5KCNH2PTGDR
SCHEMBL299979 0.93 SSTR5 (1.00) SSTR5KCNH2PTGDR
SCHEMBL10111618 0.91 SSTR5 (0.81) SSTR5KCNH2PTGDR
SCHEMBL10111350 0.89 SSTR5 (0.83) SSTR5KCNH2PTGDR
SCHEMBL10111975 0.89 SSTR5 (0.82) SSTR5KCNH2PTGDR
SCHEMBL13076434 0.88 SSTR5 (0.76) SSTR5KCNH2PTGDR
SCHEMBL289639 0.88 SSTR5 (0.89) SSTR5KCNH2PTGDR
SCHEMBL13076435 0.88 SSTR5 (0.86) SSTR5KCNH2PTGDR
SCHEMBL25313810 0.88 SSTR5 (0.89) SSTR5KCNH2PTGDR
SCHEMBL10111753 0.87 SSTR5 (0.78) SSTR5KCNH2PTGDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120041012-A1 SUBSTITUTED SPIROCYCLIC AMINES USEFUL AS ANTIDIABETIC COMPOUNDS MERCK SHARP & DOHME CORP. 2012-02-16 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-20120041012-A1 SUBSTITUTED SPIROCYCLIC AMINES USEFUL AS ANTIDIABETIC COMPOUNDS SSTR5, SSTR2, GPR119 SSTR5 1/4885KCNH2 1142/4885PTGDR 209/4885

“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.