SCHEMBL20053595

SCHEMBL20053595

CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CCCCC4)cn3)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.53
HRH3 Q9Y5N1 4/20 0.45
HPGDS O60760 2/20 0.43
CYP2D6 P10635 1/20 0.43
HPGD P15428 2/20 0.43
STAT3 P40763 4/20 0.42
ALDH1A1 P00352 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
SCHEMBL21534646 0.95 GPR119 (0.59) GPR119HRH3CYP2D6HPGD
SCHEMBL20053619 0.94 GPR119 (0.60) GPR119HRH3HPGDSHPGD
SCHEMBL15537802 0.91 GPR119 (0.48) GPR119HRH3HPGDS
SCHEMBL15539385 0.91 GPR119 (0.48) GPR119HRH3HPGDS
SCHEMBL15538721 0.90 HRH3 (0.55) HRH3HPGDALDH1A1
SCHEMBL15537715 0.89 HRH3 (0.56) GPR119HRH3HPGDALDH1A1
SCHEMBL16803798 0.88 GPR119 (0.46) GPR119HPGDSSTAT3
SCHEMBL15539134 0.88 GPR119 (0.50) GPR119HPGDS
SCHEMBL15539154 0.87 GPR119 (0.53) GPR119HRH3HPGDS
SCHEMBL15538942 0.87 GPR119 (0.53) GPR119HRH3HPGDS

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