SCHEMBL2028987

SCHEMBL2028987

CC(C)(C)OC(=O)C1CCS(=O)(=O)N1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.32
MAPK1 P28482 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 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
SCHEMBL2028983 1.00 HRH3 (0.32) HRH3MAPK1CHRM2CHRM1CHRM3
SCHEMBL2031312 1.00 HRH3 (0.32) HRH3MAPK1CHRM2CHRM1CHRM3
SCHEMBL2033338 0.90 HRH3 (0.31) HRH3MAPK1
SCHEMBL1765120 0.79 KMT2A (0.38) CHRM2CHRM3
SCHEMBL1764799 0.79 KMT2A (0.38) CHRM2CHRM3
SCHEMBL25684409 0.72 MAPK1 (0.37) HRH3MAPK1CHRM2CHRM1CHRM3
SCHEMBL7359958 0.71 MAPK1 (0.36) HRH3MAPK1CHRM2CHRM1CHRM3
SCHEMBL7379626 0.71 MAPK1 (0.36) HRH3MAPK1CHRM2CHRM1CHRM3
SCHEMBL22152561 0.71 MAPK1 (0.36) HRH3MAPK1CHRM2CHRM1CHRM3
SCHEMBL9352527 0.70 CYP2D6 (0.40) HRH3MAPK1CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110136792-A1 NOVEL CARBOXYLIC ACID ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS BOLIN DAVID ROBERT 2011-06-09 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-20110136792-A1 NOVEL CARBOXYLIC ACID ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS GYS2, GYS1, PYGL HRH3 4251/4885MAPK1 1975/4885CHRM2 1558/4885

“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.