SCHEMBL13696444

SCHEMBL13696444

CCCN1CCN(C(=O)Cn2c(=O)sc3ccc(Cl)cc32)CC1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 15/20 0.61
▸ GAA P10253 1/20 0.59
▸ TSHR P16473 1/20 0.59
▸ NPSR1 Q6W5P4 1/20 0.59
▸ TMEM97 Q5BJF2 3/20 0.57
▸ TDP1 Q9NUW8 1/20 0.52

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
Tiaramide SCHEMBL25172 0.90 NPY5R (0.58) NPY5RGAATSHRNPSR1TMEM97
Tiaramide SCHEMBL29376518 0.90 NPY5R (0.58) NPY5RGAATSHRNPSR1TMEM97
Tiaramide SCHEMBL181916 0.89 NPY5R (0.58) NPY5RGAATSHRNPSR1TMEM97
Tiaramide SCHEMBL29379184 0.89 NPY5R (0.58) NPY5RGAATSHRNPSR1TMEM97
SCHEMBL8894950 0.88 TMEM97 (0.58) NPY5RGAATSHRNPSR1TMEM97
SCHEMBL8902235 0.87 NPY5R (0.56) NPY5RGAATSHRNPSR1TMEM97
SCHEMBL11408981 0.85 NPY5R (0.57) NPY5RGAATSHRNPSR1TMEM97
SCHEMBL10546335 0.84 NPY5R (0.59) NPY5RGAATSHRNPSR1TDP1
SCHEMBL10544707 0.84 NPY5R (0.59) NPY5RGAATSHRNPSR1TMEM97
SCHEMBL10547671 0.84 NPY5R (0.61) NPY5RGAATSHRNPSR1TMEM97

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-20090239916-A1 NOVEL DRUG DISCOVERY TARGET AND MEDICINE ACTING ON THE SAME REVERSE PROTEOMICS RESEARCH INSTITUTE CO., LTD (JP) 2009-09-24 — — 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-20090239916-A1 NOVEL DRUG DISCOVERY TARGET AND MEDICINE ACTING ON THE SAME LCP2, FPR2, MFN2 NPY5R 4169/4885GAA 2054/4885TSHR 4600/4885

“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.

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