SCHEMBL8565047

SCHEMBL8565047

Cc1ccc2c(N3CC(COS(C)(=O)=O)OC3=O)csc2n1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 10/20 0.35
MAOB P27338 3/20 0.34
GRM5 P41594 3/20 0.33
ADRB3 P13945 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
SCHEMBL8802070 1.00 GRM2 (0.35) GRM2MAOBGRM5ADRB3
SCHEMBL8801297 0.84 F10 (0.40) GRM2MAOB
Hydrochloric Acid SCHEMBL8559952 0.83 F10 (0.39) GRM2MAOB
SCHEMBL8563892 0.83 MAOA (0.46) GRM2MAOB
SCHEMBL8801479 0.83 MAOA (0.46) GRM2MAOB
SCHEMBL8802069 0.79 GRM2 (0.36) GRM2MAOBGRM5
SCHEMBL8566304 0.78 MAOA (0.49) MAOB
SCHEMBL8802258 0.78 MAOA (0.49) MAOB
SCHEMBL8802647 0.77 MAOA (0.40) MAOB
SCHEMBL8564138 0.77 MAOA (0.40) MAOB

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-5827857-A BACTERICIDES AND MICROBIOCIDES; GRAMPOSITIVE BACTERIA, HEMOPHILUS INFLUENZA, ANAEROBIC MICROORGANISMS AND MYCOBACTERIA; LOW TOXICITY BAYER AKTIENGESELLSCHAFT (DE) 1998-10-27 US disclosed