SCHEMBL2289557

SCHEMBL2289557

CC(C)(C)[Si](C)(C)O[C@@H]1C[C@@H](COS(N)(=O)=O)O[C@H]1n1cnc2c(N)ncnc21

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.47
AHCY P23526 2/20 0.43
ADORA3 P0DMS8 1/20 0.43

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
SCHEMBL2289562 1.00 RXFP1 (0.47) RXFP1AHCYADORA3
SCHEMBL29390219 0.89 ADORA1 (0.45) AHCYADORA3
SCHEMBL22065156 0.89 ADORA1 (0.45) AHCYADORA3
SCHEMBL15355255 0.89 ADORA1 (0.45) AHCYADORA3
SCHEMBL20418959 0.89 ADORA1 (0.45) AHCYADORA3
SCHEMBL21859250 0.89 ADORA1 (0.45) AHCYADORA3
SCHEMBL19941913 0.88 AHCY (0.47) AHCYADORA3
SCHEMBL22508607 0.87 ADORA3 (0.51) AHCYADORA3
SCHEMBL22065053 0.87 ADORA3 (0.51) AHCYADORA3
SCHEMBL24220762 0.86 P2RY1 (0.46)

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-7989430-B2 Antibacterial agents REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2011-08-02 US disclosed
US-20080293666-A1 Antibacterial Agents REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2008-11-27 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-20080293666-A1 Antibacterial Agents MRPL21, ABCB7, MSR1 RXFP1 141/4885AHCY 3828/4885ADORA3 1669/4885

“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.