SCHEMBL27900665

SCHEMBL27900665

CC(=O)NNC(=O)c1ccc(O[C@H]2CCN(C3CCN(OC(=O)C(C)(C)C)CC3)C2=O)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.35
RAB9A P51151 1/20 0.33
KMT2A Q03164 2/20 0.32
GPR6 P46095 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
LMNA P02545 1/20 0.31
HTR1A P08908 1/20 0.30
HTR1D P28221 1/20 0.30
HTR1B P28222 1/20 0.30
HTR1F P30939 1/20 0.30
BRD4 O60885 1/20 0.30
MCHR1 Q99705 1/20 0.30
FPR2 P25090 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRK1 P41145 1/20 0.30
KCNH2 Q12809 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL15022866 0.87 KMT2A (0.48) KMT2AGPR119BRD4FPR2
SCHEMBL2597085 0.87 KMT2A (0.48) KMT2AGPR119BRD4FPR2
SCHEMBL14918034 0.85 KMT2A (0.37) HRH3RAB9AKMT2AGPR6HTT
SCHEMBL27918474 0.82 FPR2 (0.38) GPR6GPR119MCHR1FPR2
SCHEMBL16011162 0.77 HRH3 (0.34) HRH3RAB9AKMT2AHTT
SCHEMBL27900696 0.76 MCHR1 (0.34) L3MBTL1MCHR1FPR2
SCHEMBL2597221 0.74 GPR119 (0.47) KMT2AGPR119FPR2
SCHEMBL14918071 0.74 GPR119 (0.47) KMT2AGPR119FPR2
SCHEMBL2596996 0.73 GPR119 (0.48) KMT2AGPR119FPR2
SCHEMBL2596997 0.73 GPR119 (0.48) KMT2AGPR119FPR2

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
CN-103080101-A Piperidinyl-substituted lactams as GPR119 modulators ARRAY BIOPHARMA INC 2013-05-01 CN disclosed