SCHEMBL336647

SCHEMBL336647

COc1cc([C@@H](COCc2ccccc2)CO[Si](C)(C)C(C)(C)C)c(N)c(N)n1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.36
TAAR1 Q96RJ0 1/20 0.35
CASR P41180 1/20 0.31
ALDH1A1 P00352 2/20 0.31
HTT P42858 2/20 0.31
TACR1 P25103 4/20 0.31
CA1 P00915 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL1774367 0.74 CA1 (0.33) GHSRCASRALDH1A1HTTTACR1
SCHEMBL1775195 0.71 TACR1 (0.47) TACR1CA1
SCHEMBL10128117 0.71 TAAR1 (0.38) GHSRTAAR1CASRTACR1CA1
SCHEMBL4982796 0.70 CA1 (0.41) CASRHTTTACR1CA1NPC1
SCHEMBL18049467 0.69 CA1 (0.41) CASRHTTTACR1CA1
SCHEMBL3784560 0.69 CA1 (0.42) CASRHTTTACR1CA1
SCHEMBL21131995 0.69 CA1 (0.56) CASRALDH1A1HTTCA1
SCHEMBL19890114 0.69 CA1 (0.56) CASRALDH1A1HTTCA1
SCHEMBL3521570 0.69 CA1 (0.42) CASRHTTTACR1CA1
SCHEMBL4981492 0.69 CA1 (0.56) CASRALDH1A1HTTCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2300476-B1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS AND THEIR USE AS ANTIBACTERIALS GLAXO GROUP LTD (GB) 2014-01-08 EP disclosed
US-8097628-B2 Compounds GLAXO GROUP LIMITED (GB) 2012-01-17 US disclosed
EP-2300476-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS AND THEIR USE AS ANTIBACTERIALS Glaxo Group Limited (GB) 2011-03-30 EP disclosed
US-20090306089-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-12-10 US disclosed
WO-2009141398-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS AND THEIR USE AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2009-11-26 WO 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-20090306089-A1 COMPOUNDS SDHA, NQO1, SDHB GHSR 4303/4885TAAR1 3121/4885CASR 4855/4885

“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.