SCHEMBL4349657

SCHEMBL4349657

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

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.44
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CHRM5 P08912 2/20 0.42
CHRM2 P08172 1/20 0.42
CHRM3 P20309 1/20 0.42
P2RY12 Q9H244 2/20 0.39
CHRM1 P11229 1/20 0.39
KCNH2 Q12809 2/20 0.39
HRH3 Q9Y5N1 2/20 0.39
HTR1A P08908 1/20 0.39
SLC6A4 P31645 1/20 0.39
HRH1 P35367 1/20 0.39
RAB9A P51151 1/20 0.38
NPY2R P49146 1/20 0.38
MAPK1 P28482 1/20 0.38
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL4358687 0.92 SMN1; SMN2 (0.46) ALDH1A1KDM4ESMN1; SMN2CHRM5CHRM2
SCHEMBL4531625 0.92 ALDH1A1 (0.40) ALDH1A1KDM4ESMN1; SMN2CHRM5CHRM2
SCHEMBL4350015 0.92 GPR119 (0.41) GPR119ALDH1A1KDM4ESMN1; SMN2CHRM5
SCHEMBL4354226 0.91 KDM4E (0.45) ALDH1A1KDM4ESMN1; SMN2CHRM5CHRM2
SCHEMBL4352059 0.91 P2RY12 (0.41) GPR119ALDH1A1KDM4ESMN1; SMN2CHRM5
SCHEMBL4354023 0.91 SMN1; SMN2 (0.44) ALDH1A1KDM4ESMN1; SMN2CHRM5CHRM2
SCHEMBL4358519 0.91 KDM4E (0.41) GPR119ALDH1A1KDM4ESMN1; SMN2CHRM5
SCHEMBL4523985 0.91 KDM4E (0.41) GPR119ALDH1A1KDM4ESMN1; SMN2CHRM5
SCHEMBL4347832 0.91 GPR119 (0.56) GPR119KDM4ERAB9A
SCHEMBL4356877 0.90 ALDH1A1 (0.45) ALDH1A1KDM4ESMN1; SMN2CHRM5CHRM2

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

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