SCHEMBL30524

SCHEMBL30524

COCCOC(=O)C1(OCCOC)CCC(c2cc(N(S(=O)(=O)COCC[Si](C)(C)C)S(=O)(=O)COCC[Si](C)(C)C)n3ncc(-c4cnn(-c5ccccc5)c4)c3n2)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 3/20 0.32

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
SCHEMBL21073 0.91 GRM4 (0.34) GRM4
SCHEMBL47762 0.86 CHEK1 (0.38) GRM4
SCHEMBL21078 0.86 GRM4 (0.34) GRM4
SCHEMBL15006968 0.85 JAK2 (0.31)
SCHEMBL15031440 0.85 JAK2 (0.31)
SCHEMBL15006969 0.85 JAK2 (0.31)
SCHEMBL15007081 0.85 GRM4 (0.34) GRM4
SCHEMBL15007380 0.81 GRM4 (0.33) GRM4
SCHEMBL15007382 0.81 GRM4 (0.33) GRM4
SCHEMBL19684 0.81 GRM4 (0.32) GRM4

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
EP-2608668-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN Merck Sharp & Dohme Corp. (US) 2013-07-03 EP disclosed
WO-2012027234-A1 FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN SCHERING CORPORATION (US) 2012-03-01 WO disclosed