SCHEMBL4352065

SCHEMBL4352065

COCCNC(=O)c1ccc(-c2ccc3c(c2)COC(C2CCN(C(=O)OCC4(C)CC4)CC2)O3)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.37
KDM4E B2RXH2 2/20 0.37
CHRM5 P08912 2/20 0.35
NAMPT P43490 2/20 0.35
CHRM2 P08172 1/20 0.35
CHRM3 P20309 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
CYP2C9 P11712 1/20 0.35
MAPK14 Q16539 1/20 0.35
CHRM1 P11229 4/20 0.35
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
P2RY12 Q9H244 1/20 0.34
HTT P42858 1/20 0.33
EPHX2 P34913 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL4350129 0.93 KDM4E (0.37) ALDH1A1SMN1; SMN2KDM4ECHRM5NAMPT
SCHEMBL4348559 0.92 MAPK14 (0.37) ALDH1A1SMN1; SMN2KDM4ECHRM5CHRM2
SCHEMBL4350015 0.91 GPR119 (0.41) ALDH1A1SMN1; SMN2KDM4ECHRM5CHRM2
SCHEMBL4354226 0.91 KDM4E (0.45) ALDH1A1SMN1; SMN2KDM4ECHRM5NAMPT
SCHEMBL4353651 0.90 KCNH2 (0.38) ALDH1A1SMN1; SMN2KMT2AMEN1TP53
SCHEMBL4353425 0.90 SCD5 (0.36) ALDH1A1SMN1; SMN2KDM4EP2RY12
SCHEMBL4522943 0.89 ALDH1A1 (0.36) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL4532899 0.89 KDM4E (0.36) ALDH1A1SMN1; SMN2KDM4ECHRM5CHRM2
SCHEMBL4349648 0.88 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2KDM4ECHRM5CHRM2
SCHEMBL4534628 0.87 GPR119 (0.40) CHRM2

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