SCHEMBL3134676

SCHEMBL3134676

CC(C)(C)[Si](C)(C)OCc1cc(C(N)=NO)co1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.31
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL3134668 1.00 NPSR1 (0.31) NPSR1GAARAB9ARECQL
SCHEMBL3134995 0.75 NPSR1 (0.31) NPSR1GAARAB9ARECQL
SCHEMBL3138500 0.75 NPSR1 (0.31) NPSR1GAARAB9ARECQL
SCHEMBL4500432 0.75 RECQL (0.39) NPSR1GAARAB9ARECQL
SCHEMBL4500429 0.75 RECQL (0.39) NPSR1GAARAB9ARECQL
SCHEMBL3134681 0.75 ELANE (0.34)
SCHEMBL1872937 0.74 CYP1A2 (0.39) NPSR1GAARAB9ARECQL
SCHEMBL3138382 0.73 NPC1 (0.35) GAARAB9A
SCHEMBL3138375 0.73 NPC1 (0.35) GAARAB9A
SCHEMBL3150939 0.72 GAA (0.39) NPSR1GAARAB9ARECQL

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-7687491-B2 Heterocyclic compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-03-30 US disclosed
US-20080113961-A1 Immunosuppressants with low toxicity; 1-({4-Methyl-5-[5-(4-phenoxyphenyl)-1,2,4-oxadiazol-3-yl]-2-thienyl}methyl)azetidine-3-carboxylic acid for example; autoimmune diseases and transplant rejection; N-substituted azetidine, pyrrolidine or piperidine compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-05-15 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-20080113961-A1 Immunosuppressants with low toxicity; 1-({4-Methyl-5-[5-(4-phenoxyphenyl)-1,2,4-oxadiazol-3-yl]-2-thienyl}methyl)azetidine-3-carboxylic acid for example; autoimmune diseases and transplant rejection; N-substituted azetidine, pyrrolidine or piperidine compounds TPMT, AZI2, IDO1 NPSR1 2151/4885GAA 1708/4885RAB9A 202/4885

“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.