SCHEMBL7928160

SCHEMBL7928160

CCCCCC[C@@H]1Cn2c(nc3cc(N)ccc32)O1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 19/20 0.48
KDM4E B2RXH2 1/20 0.38
RAD52 P43351 1/20 0.38

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
SCHEMBL7924595 1.00 GRM2 (0.48) GRM2KDM4ERAD52
SCHEMBL7926084 0.88 KDM4E (0.38) GRM2KDM4ERAD52
SCHEMBL7922728 0.88 GRM2 (0.36) GRM2KDM4ERAD52
SCHEMBL7915024 0.84 GRM2 (0.32) GRM2KDM4ERAD52
SCHEMBL7927257 0.84 GRM2 (0.32) GRM2KDM4ERAD52
SCHEMBL12441128 0.83 GRM2 (0.50) GRM2KDM4E
SCHEMBL12441180 0.83 GRM2 (0.50) GRM2KDM4E
SCHEMBL7923909 0.83 GRM2 (0.47) GRM2
SCHEMBL2219269 0.83 GRM2 (0.47) GRM2
SCHEMBL7922412 0.83 GRM2 (0.47) 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
WO-2010036544-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2010-04-01 WO disclosed