SCHEMBL8074091

SCHEMBL8074091

CC(C)c1noc(N2CCC([C@H](C)CCOc3ccc([C@H](NC(=O)OC(C)(C)C)C(=O)N4CCC[C@H]4N)cc3)CC2)n1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 10/20 0.37
HRH1 P35367 10/20 0.37
GPR119 Q8TDV5 6/20 0.37
KCNH2 Q12809 1/20 0.37
F2RL3 Q96RI0 2/20 0.35
GPR183 P32249 1/20 0.34
ACACB O00763 1/20 0.34
LMNA P02545 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
SCHEMBL2897630 0.92 HRH2 (0.36) HRH2HRH1GPR119KCNH2F2RL3
SCHEMBL2897633 0.92 HRH2 (0.36) HRH2HRH1GPR119KCNH2F2RL3
SCHEMBL8070582 0.92 HRH2 (0.37) HRH2HRH1F2RL3ACACBLMNA
SCHEMBL13067274 0.92 HRH2 (0.38) HRH2HRH1GPR119KCNH2F2RL3
SCHEMBL2891730 0.92 HRH2 (0.38) HRH2HRH1GPR119KCNH2F2RL3
SCHEMBL2891733 0.92 HRH2 (0.38) HRH2HRH1GPR119KCNH2F2RL3
SCHEMBL8066261 0.91 GPR119 (0.44) HRH2HRH1GPR119KCNH2F2RL3
SCHEMBL2899900 0.88 GPR119 (0.40) HRH2HRH1GPR119KCNH2GPR183
SCHEMBL2899896 0.88 GPR119 (0.40) HRH2HRH1GPR119KCNH2GPR183
SCHEMBL2897005 0.88 GPR119 (0.40) HRH2HRH1GPR119KCNH2GPR183

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-2009034388-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2009-03-19 WO disclosed