SCHEMBL13516630

SCHEMBL13516630

CCn1sc(=O)n(C)c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RGS4 P49798 10/20 1.00
RGS8 P57771 9/20 1.00
GSK3B P49841 9/20 0.61
GSK3A P49840 6/20 0.61
PRKCA P17252 1/20 0.46
KAT2B Q92831 2/20 0.39

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
SCHEMBL13739816 0.77 RGS4 (0.63) RGS4RGS8GSK3BGSK3A
SCHEMBL13517588 0.70 RGS4 (1.00) RGS4RGS8GSK3BGSK3APRKCA
SCHEMBL18691723 0.70 GSK3B (0.67) RGS4RGS8GSK3BGSK3APRKCA
SCHEMBL13562489 0.69 RGS4 (0.73) RGS4RGS8GSK3BGSK3APRKCA
SCHEMBL5023672 0.69
SCHEMBL13517328 0.69 RGS4 (1.00) RGS4RGS8GSK3BGSK3APRKCA
SCHEMBL13562487 0.68 RGS4 (0.81) RGS4RGS8GSK3BGSK3APRKCA
SCHEMBL3381333 0.67 GSK3B (1.00) RGS4RGS8GSK3BGSK3APRKCA
SCHEMBL13562484 0.67 RGS4 (0.68) RGS4RGS8GSK3BGSK3APRKCA
SCHEMBL6015126 0.66 GSK3B (1.00) RGS4RGS8GSK3BGSK3APRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8865750-B2 Small molecule inhibitors of RGS proteins THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-10-21 US disclosed
US-8865750-B2 Small molecule inhibitors of RGS proteins THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-10-21 US disclosed
US-8865750-B2 Small molecule inhibitors of RGS proteins THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2014-10-21 US disclosed
WO-2012149335-A2 SMALL MOLECULE INHIBITORS OF RGS PROTEINS NEUBIG RICHARD (US) 2012-11-01 WO disclosed
US-20120277273-A1 SMALL MOLECULE INHIBITORS OF RGS PROTEINS THE UNIVERSITY OF BATH (GB) 2012-11-01 US disclosed
US-20120277273-A1 SMALL MOLECULE INHIBITORS OF RGS PROTEINS THE UNIVERSITY OF BATH (GB) 2012-11-01 US disclosed
US-20120277273-A1 SMALL MOLECULE INHIBITORS OF RGS PROTEINS THE UNIVERSITY OF BATH (GB) 2012-11-01 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-20120277273-A1 SMALL MOLECULE INHIBITORS OF RGS PROTEINS RGS4, RGS16, RGS12 RGS4 1/4885RGS8 4/4885GSK3B 245/4885

“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.