SCHEMBL14477477

SCHEMBL14477477

COc1cc(C(=O)N2CCC[C@H]2CO[Si](C)(C)C(C)(C)C)c(N=C=O)cc1C

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 17/20 0.39
HCRTR2 O43614 17/20 0.39
FKBP1A P62942 1/20 0.39
CYP3A4 P08684 2/20 0.38
LRRK2 Q5S007 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
SCHEMBL4411420 0.94 HCRTR1 (0.41) HCRTR1HCRTR2FKBP1ALRRK2
SCHEMBL14071788 0.94 HCRTR1 (0.41) HCRTR1HCRTR2FKBP1ALRRK2
SCHEMBL4406340 0.88 HCRTR1 (0.40) HCRTR1HCRTR2FKBP1ALRRK2
SCHEMBL14071838 0.88 HCRTR1 (0.40) HCRTR1HCRTR2FKBP1ALRRK2
SCHEMBL14071842 0.88 HCRTR1 (0.40) HCRTR1HCRTR2FKBP1ALRRK2
SCHEMBL14477478 0.87 LRRK2 (0.41) HCRTR1HCRTR2FKBP1ALRRK2
SCHEMBL14477479 0.84 LRRK2 (0.40) HCRTR1HCRTR2FKBP1ALRRK2
SCHEMBL4409498 0.79 HCRTR1 (0.42) HCRTR1HCRTR2FKBP1ALRRK2
SCHEMBL14071787 0.79 HCRTR1 (0.42) HCRTR1HCRTR2FKBP1ALRRK2
SCHEMBL13594853 0.78 HCRTR1 (0.42) HCRTR1HCRTR2LRRK2

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-8653269-B2 Process for preparation of t-butoxycarbonylamine compounds NIPPON SODA CO., LTD. (JP) 2014-02-18 US disclosed
US-20130005981-A1 PROCESS FOR PREPARATION OF t-BUTOXYCARBONYLAMINE COMPOUNDS NIPPON SODA CO., LTD. (JP) 2013-01-03 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-20130005981-A1 PROCESS FOR PREPARATION OF t-BUTOXYCARBONYLAMINE COMPOUNDS BPGM, TST, BET1 HCRTR1 4591/4885HCRTR2 4307/4885FKBP1A 4701/4885

“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.