SCHEMBL20053741

SCHEMBL20053741

CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CCCC4)cc3)nn2)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.44
HRH3 Q9Y5N1 5/20 0.41
BCHE P06276 2/20 0.40
ACHE P22303 2/20 0.40
NR3C1 P04150 5/20 0.39
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
RAB9A P51151 1/20 0.38
PGR P06401 3/20 0.38
ADRB2 P07550 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP2D6 P10635 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
MLYCD O95822 1/20 0.37

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
SCHEMBL15538352 0.92 GRM3 (0.40) GPR119HRH3BCHEACHEHDAC4
SCHEMBL15538353 0.92 GRM3 (0.40) GPR119HRH3BCHEACHEHDAC4
SCHEMBL20053731 0.91 GPR119 (0.41) GPR119HRH3BCHEACHENR3C1
SCHEMBL15539714 0.89 ACHE (0.45) GPR119BCHEACHE
SCHEMBL15538194 0.87 BCHE (0.41) GPR119BCHEACHE
SCHEMBL20053643 0.87 GPR119 (0.43) GPR119HRH3BCHEACHENR3C1
SCHEMBL20053577 0.86 GPR119 (0.45) GPR119HRH3ADRB2HPGDCYP2D6
SCHEMBL15538466 0.86 SPHK1 (0.43) GPR119BCHEACHEALDH1A1L3MBTL1
SCHEMBL15538168 0.86 SPHK1 (0.43) GPR119BCHEACHEALDH1A1L3MBTL1
SCHEMBL20053619 0.85 GPR119 (0.60) GPR119HRH3KDM4EHPGDL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2858986-B1 PIPERIDINE DERIVATIVES AS GPR119 AGONISTS CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2019-10-30 EP disclosed
US-9944600-B2 Piperidine derivatives for GPR119 agonist CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2018-04-17 US disclosed