SCHEMBL2916151

SCHEMBL2916151

COC(=O)CCC1NCCCc2cc(-c3noc(-c4ccc(OC(C)C)c(Cl)c4)n3)ccc21

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 19/20 0.59
S1PR3 Q99500 9/20 0.58
MAP4K4 O95819 1/20 0.51
MINK1 Q8N4C8 1/20 0.51

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
SCHEMBL3075024 0.92 S1PR1 (0.68) S1PR1S1PR3MAP4K4MINK1
SCHEMBL2916510 0.92 S1PR1 (0.59) S1PR1S1PR3MAP4K4MINK1
Hydrochloric Acid SCHEMBL3092240 0.92 S1PR1 (0.68) S1PR1S1PR3MAP4K4MINK1
SCHEMBL3076059 0.88 S1PR1 (0.62) S1PR1S1PR3MAP4K4MINK1
Hydrochloric Acid SCHEMBL3070835 0.87 S1PR1 (0.61) S1PR1S1PR3MAP4K4MINK1
SCHEMBL2915924 0.80 S1PR1 (0.54) S1PR1S1PR3MAP4K4MINK1
SCHEMBL1969510 0.78 S1PR1 (0.69) S1PR1S1PR3MAP4K4MINK1
SCHEMBL3070539 0.76 S1PR1 (0.58) S1PR1S1PR3MAP4K4MINK1
SCHEMBL13045463 0.75 S1PR1 (0.75) S1PR1S1PR3MAP4K4MINK1
SCHEMBL2991967 0.74 S1PR1 (1.00) S1PR1S1PR3MAP4K4MINK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100273770-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 2010-10-28 US disclosed
US-20100273770-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 2010-10-28 US disclosed
US-20100273770-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 2010-10-28 US disclosed
EP-2220077-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES Glaxo Group Limited (GB) 2010-08-25 EP disclosed
WO-2009080730-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 2009-07-02 WO disclosed
WO-2009080730-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES GLAXO GROUP LIMITED (GB) 2009-07-02 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-20100273770-A1 1, 2, 4 -OXADIAZOLE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASES SSB, RORC, OXA1L S1PR1 605/4885S1PR3 505/4885MAP4K4 2723/4885

“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.