SCHEMBL336341

SCHEMBL336341

COC(=O)c1ncc(CO[Si](C)(C)C(C)(C)C)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 3/20 0.34
ALDH1A1 P00352 1/20 0.34
S1PR4 O95977 1/20 0.34
TRPV1 Q8NER1 3/20 0.34
CNR2 P34972 1/20 0.33
BACE1 P56817 2/20 0.33
KDM5A P29375 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
USP14 P54578 1/20 0.32
TP53 P04637 1/20 0.32
KMT2A Q03164 1/20 0.32
VEGFA P15692 1/20 0.32
FLT1 P17948 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
EGLN3 Q9H6Z9 1/20 0.32

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
SCHEMBL7886384 0.82 BACE1 (0.40) MRGPRX4ALDH1A1S1PR4TRPV1BACE1
SCHEMBL24661702 0.79 PDE4A (0.42) MRGPRX4ALDH1A1S1PR4KMT2A
SCHEMBL334852 0.78 ALDH1A1 (0.36) ALDH1A1USP14
SCHEMBL336686 0.78 ALDH1A1 (0.40) MRGPRX4ALDH1A1S1PR4TRPV1KMT2A
SCHEMBL16375219 0.77 POLB (0.36) MRGPRX4ALDH1A1S1PR4BACE1KDM5A
SCHEMBL336013 0.76 USP14 (0.31) USP14
SCHEMBL31133002 0.75 MRGPRX4 (0.36) MRGPRX4ALDH1A1CNR2TP53KMT2A
SCHEMBL10009163 0.75 GRM5 (0.49) MRGPRX4ALDH1A1KMT2A
SCHEMBL31133239 0.75 MRGPRX4 (0.36) MRGPRX4ALDH1A1CNR2TP53KMT2A
SCHEMBL15620009 0.75 MAPK1 (0.49) ALDH1A1BACE1

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 11 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
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
US-8097628-B2 Compounds GLAXO GROUP LIMITED (GB) 2012-01-17 US 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
US-20090306089-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-12-10 US 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
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 MRGPRX4 1281/4885ALDH1A1 612/4885S1PR4 3597/4885

“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.