SCHEMBL14875005

SCHEMBL14875005

CC(C)(C)OC(=O)ON1CCC(c2nc(CNc3ccc(-n4cnnn4)cc3)cs2)CC1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.60
POLB P06746 1/20 0.38
ADRB2 P07550 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
ALOX15 P16050 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
IDH1 O75874 1/20 0.35
HPGD P15428 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
SCHEMBL3488622 0.89 GPR119 (0.75) GPR119ALDH1A1KDM4EHTTL3MBTL1
SCHEMBL14874928 0.86 GPR119 (0.79) GPR119POLBMAPTMEN1KMT2A
SCHEMBL14874905 0.85 GPR119 (0.53) GPR119POLBADRB2MAPTSMN1; SMN2
SCHEMBL14874871 0.83 GPR119 (0.39) GPR119
SCHEMBL14874908 0.82 GPR119 (0.75) GPR119POLBMAPTMEN1KMT2A
SCHEMBL14874967 0.82 GPR119 (0.63) GPR119
SCHEMBL14874841 0.81 GPR119 (0.62) GPR119
SCHEMBL14874833 0.80 GPR119 (0.40) GPR119MAPT
SCHEMBL14874865 0.80 GPR119 (0.60) GPR119
SCHEMBL27870728 0.79 GPR119 (0.78) GPR119POLBMAPTMEN1KMT2A

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
EP-2111107-B1 HETEROCYCLIC RECEPTOR AGONISTS FOR THE TREATMENT OF DIABETES AND METABOLIC DISORDERS METABOLEX INC (US) 2013-04-24 EP claimed