SCHEMBL20053705

SCHEMBL20053705

NC(=O)[C@H]1CCCCN1C(=O)c1ccc(-c2ccc(NCC3CCN(CC4(C(F)(F)F)CCC4)CC3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.40
JAK2 O60674 1/20 0.38
SPHK1 Q9NYA1 4/20 0.38
SPHK2 Q9NRA0 2/20 0.38
DPP4 P27487 3/20 0.37
PIK3CA P42336 4/20 0.36
MTOR P42345 3/20 0.36
HSD11B1 P28845 1/20 0.35
VNN1 O95497 1/20 0.35
HTR1A P08908 2/20 0.34
HTR7 P34969 2/20 0.34
SSTR5 P35346 1/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34

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
SCHEMBL20053632 0.97 PDK2 (0.43) PDK2JAK2SPHK1SPHK2DPP4
SCHEMBL15538724 0.88 HCRTR1 (0.40) PDK2DPP4HTR1AHTR7
SCHEMBL15539668 0.88 HCRTR1 (0.40) PDK2DPP4HTR1AHTR7
SCHEMBL16803935 0.87 JAK2 (0.40) JAK2SPHK1SPHK2DPP4PIK3CA
SCHEMBL15540105 0.85 PDK2 (0.42) PDK2DPP4HTR1AHTR7
SCHEMBL15539597 0.85 PDK2 (0.42) PDK2DPP4HTR1AHTR7
SCHEMBL21534694 0.85 SSTR5 (0.32) SSTR5
SCHEMBL16803933 0.84 DPP4 (0.41) PDK2JAK2SPHK1SPHK2DPP4
SCHEMBL21534659 0.84 PDK2 (0.41) PDK2JAK2SPHK1SPHK2DPP4
SCHEMBL16803775 0.84 PDK2 (0.41) PDK2JAK2SPHK1SPHK2DPP4

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