SCHEMBL565122

SCHEMBL565122

CC(C)(C)OC(=O)NC1(COS(C)(=O)=O)COC(C)(C)OC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.31
CA14 Q9ULX7 2/20 0.31
CA1 P00915 1/20 0.31
CA7 P43166 1/20 0.31
CA2 P00918 1/20 0.31
HCRTR2 O43614 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
SCHEMBL1222689 0.84
SCHEMBL10239091 0.83 CA12 (0.36) CA12CA14CA1CA7CA2
SCHEMBL18131268 0.81 P2RX7 (0.36) CA12CA14CA1CA7CA2
SCHEMBL79673 0.80 TDP1 (0.35) CA1CA7CA2HCRTR2
SCHEMBL29169997 0.80 HCRTR2 (0.34) CA12CA14CA1CA7CA2
SCHEMBL425587 0.80 EPHX2 (0.36) CA12CA14CA1CA7CA2
SCHEMBL2876384 0.80 P2RX7 (0.40) CA12CA14CA1CA7CA2
SCHEMBL437782 0.79 TDP1 (0.33) HCRTR2
SCHEMBL436763 0.79 APLNR (0.31) HCRTR2
SCHEMBL1222522 0.78 HCRTR2 (0.33) HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181182-B2 S1P receptors modulators AKAAL PHARMA PTY LTD (AU) 2015-11-10 US disclosed
US-20120034270-A1 S1P Receptors Modulators AKAAL PHARMA PTY LTD (AU) 2012-02-09 US disclosed
EP-2344446-A1 S1P RECEPTORS MODULATORS Akaal Pharma Pty Ltd (AU) 2011-07-20 EP disclosed
WO-2010042998-A1 S1P RECEPTORS MODULATORS AKAAL PHARMA PTY LTD (AU) 2010-04-22 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-20120034270-A1 S1P Receptors Modulators S1PR1, S1PR5, S1PR3 CA12 4777/4885CA14 4848/4885CA1 4809/4885

“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.