SCHEMBL1760992

SCHEMBL1760992

COc1ncnc2sc(NC(=O)N3CCN(Cc4cc(Cl)cc(Cl)c4OC(=O)C(F)(F)F)CC3)nc12

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.34
HSD17B1 P14061 1/20 0.34
HSD17B2 P37059 1/20 0.34
EPHX2 P34913 3/20 0.33
GPR6 P46095 2/20 0.33
FAAH O00519 2/20 0.33
PDCD1LG2 Q9BQ51 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
TP53 P04637 2/20 0.32
LMNA P02545 1/20 0.32
PDGFRB P09619 2/20 0.32
TRPV1 Q8NER1 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 1/20 0.32
MAPT P10636 1/20 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
SCHEMBL1760885 0.88 RBP4 (0.40) RBP4GPR6FAAHTP53MAPT
SCHEMBL1761060 0.86 FAAH (0.40) RBP4HSD17B1HSD17B2EPHX2FAAH
SCHEMBL1761045 0.84 ACHE (0.39) EPHX2GPR6FAAHPDCD1LG2CD274
SCHEMBL1761072 0.84 ACHE (0.39) EPHX2GPR6FAAHPDCD1LG2CD274
SCHEMBL1761008 0.83 KDM4E (0.37) EPHX2GPR6FAAHPDCD1LG2CD274
SCHEMBL1761013 0.83 HSD17B10 (0.44) GPR6FAAHPDGFRBADORA2AMAPT
SCHEMBL1760990 0.82 PKM (0.41) FAAHPDGFRB
SCHEMBL1761069 0.81 FAAH (0.42) RBP4EPHX2FAAHPDCD1LG2CD274
SCHEMBL1761054 0.80 FAAH (0.52) RBP4FAAHPDCD1LG2CD274LMNA
SCHEMBL1761028 0.79 FAAH (0.47) FAAHLMNAADORA2AMAPT

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-7947692-B2 Substituted thiazolo[5,4-d]pyrimidine urea derivatives HOFFMANN-LA ROCHE INC. (US) 2011-05-24 US disclosed