SCHEMBL4050096

SCHEMBL4050096

CCOC(=O)N1CCC(COc2ccc(-c3ccc(C(=O)N4CCN(C)CC4)cn3)cc2COC)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.45
ALDH1A1 P00352 5/20 0.43
POLB P06746 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GPR119 Q8TDV5 5/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
FLT3 P36888 1/20 0.39
TYRO3 Q06418 1/20 0.39
MERTK Q12866 1/20 0.39
GAS6 Q14393 1/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
SETD7 Q8WTS6 1/20 0.39
GLA P06280 1/20 0.39
LMNA P02545 1/20 0.38

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
SCHEMBL4051428 0.91 GPR119 (0.39) GPR119KMT2AMEN1FLT3TYRO3
SCHEMBL4562706 0.91 GPR119 (0.53) GPR119FLT3TYRO3MERTKGAS6
SCHEMBL13691397 0.91 GPR119 (0.53) GPR119
SCHEMBL4054769 0.89 GPR119 (0.39) GPR119FLT3TYRO3MERTKGAS6
SCHEMBL4052440 0.88 RBP4 (0.40) FLT3TYRO3MERTKGAS6HPGD
SCHEMBL4052939 0.87 SLC6A7 (0.44) ALDH1A1GPR119HPGDKDM4E
SCHEMBL4052205 0.85 RAB9A (0.44) RAB9AALDH1A1POLBCYP2C19NPSR1
SCHEMBL13691402 0.80 GPR119 (0.56) GPR119
SCHEMBL4562576 0.76 GPR119 (0.44) GPR119
SCHEMBL4052686 0.76 TRPC6 (0.42) RAB9A

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
WO-2009106565-A1 AGONISTS OF GPR119 BIOVITRUM AB (PUBL) (SE) 2009-09-03 WO disclosed