SCHEMBL20053540

SCHEMBL20053540

CCC(F)(CC)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CCCC4)cc3)nc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.56
HRH3 Q9Y5N1 5/20 0.46
CYP4F2 P78329 3/20 0.43
CYP4A11 Q02928 3/20 0.43
HPGD P15428 3/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HPGDS O60760 2/20 0.42
RBP4 P02753 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL15539327 0.92 GPR119 (0.50) GPR119HRH3CYP4F2CYP4A11HPGDS
SCHEMBL15539331 0.92 GPR119 (0.50) GPR119HRH3CYP4F2CYP4A11HPGDS
SCHEMBL20053619 0.91 GPR119 (0.60) GPR119HRH3CYP4F2CYP4A11HPGD
SCHEMBL21534646 0.90 GPR119 (0.59) GPR119HRH3CYP4F2CYP4A11HPGD
SCHEMBL16769011 0.90 GPR119 (0.51) GPR119HRH3CYP4F2CYP4A11HPGDS
SCHEMBL15538422 0.89 GPR119 (0.51) GPR119CYP4F2CYP4A11HPGDSSMN1; SMN2
SCHEMBL21534807 0.88 GPR119 (0.43) GPR119HRH3HPGDKDM4EL3MBTL1
SCHEMBL15539367 0.88 GPR119 (0.53) GPR119CYP4F2CYP4A11HPGDSSMN1; SMN2
SCHEMBL21535116 0.88 GPR119 (0.49) GPR119HRH3CYP4F2CYP4A11HPGDS
SCHEMBL20053543 0.88 GPR119 (0.54) GPR119CYP4F2CYP4A11HPGDS

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-9944600-B2 Piperidine derivatives for GPR119 agonist CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2018-04-17 US disclosed