SCHEMBL27748812

SCHEMBL27748812

CCCCN1C=CC(C)=CC1.FC(F)F.N=S

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.35

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
SCHEMBL27637563 0.95 GRM2 (0.37) GRM2
SCHEMBL28944256 0.94 PTGS1 (0.33) GRM2
SCHEMBL24938714 0.89 GRM2 (0.37) GRM2
Water SCHEMBL27734060 0.87 GRM2 (0.36) GRM2
Hydrochloric Acid SCHEMBL5029015 0.87 GRM2 (0.36) GRM2
Hydrochloric Acid SCHEMBL27700902 0.87 GRM2 (0.36) GRM2
Bromide SCHEMBL27008655 0.87 GRM2 (0.36) GRM2
Iodide SCHEMBL27984305 0.87 GRM2 (0.36) GRM2
SCHEMBL31258321 0.86 GRM2 (0.35) GRM2
SCHEMBL16965876 0.86 GRM2 (0.37) GRM2

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
CN-101472932-A Method for production of organosilicon compounds by hydrosilylation in ionic liquids WACKER CHEMIE AG (DE) 2009-07-01 CN disclosed