SCHEMBL4538002

SCHEMBL4538002

CCNC(=O)c1ccc(-c2ccc3c(c2)COC(C2CCN(C(=O)O)CC2)O3)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 1/20 0.42
KCNH2 Q12809 2/20 0.40
HRH3 Q9Y5N1 2/20 0.40
HTR1A P08908 1/20 0.40
SLC6A4 P31645 1/20 0.40
HRH1 P35367 1/20 0.40
GPR119 Q8TDV5 3/20 0.40
GAA P10253 1/20 0.38
MAPK14 Q16539 1/20 0.37
NAMPT P43490 2/20 0.35
CD274 Q9NZQ7 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
OPRM1 P35372 2/20 0.35
OPRD1 P41143 2/20 0.35
PARP1 P09874 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
IP6K1 Q92551 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 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
SCHEMBL13586043 0.91 NPY2R (0.43) NPY2RKCNH2HRH3HTR1ASLC6A4
SCHEMBL4349657 0.90 GPR119 (0.44) NPY2RKCNH2HRH3HTR1ASLC6A4
SCHEMBL4533473 0.90 LMNA (0.40) SLC6A4GAANAMPTCD274
SCHEMBL4534161 0.89 SCD5 (0.41) NPY2RKCNH2HRH3GPR119KMT2A
SCHEMBL4540400 0.89 GPR119 (0.35) NPY2RKCNH2HRH3HTR1ASLC6A4
SCHEMBL4540129 0.89 ALDH1A1 (0.43) MAPK14NAMPTCD274MEN1KMT2A
SCHEMBL4538200 0.88 POLB (0.42) HRH3GAACD274MEN1KMT2A
SCHEMBL4361277 0.88 MAPK14 (0.40) SLC6A4MAPK14NAMPTCD274
SCHEMBL4360517 0.88 NAMPT (0.41) NPY2RGPR119NAMPTCD274
SCHEMBL4347832 0.88 GPR119 (0.56) GPR119KMT2A

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-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed