SCHEMBL13618757

SCHEMBL13618757

Nc1ccc(-n2nnc3ccccc32)cc1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
NPC1 O15118 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
IP6K1 Q92551 1/20 0.47
KMT2A Q03164 5/20 0.45
GFER P55789 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
KCNMA1 Q12791 1/20 0.42
TNKS O95271 1/20 0.42
MGAM O43451 2/20 0.41
AMY1A P0DUB6 2/20 0.41
GAA P10253 2/20 0.41
SI P14410 2/20 0.41
MGAM2 Q2M2H8 2/20 0.41
F2 P00734 1/20 0.41
HPGD P15428 1/20 0.41
SLC9A1 P19634 1/20 0.41
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL16882633 0.84 ALDH1A1 (0.51) KDM4ENPC1L3MBTL1KMT2ASMN1; SMN2
SCHEMBL20687098 0.83 NPC1 (0.43) KDM4ENPC1L3MBTL1KMT2ASMN1; SMN2
SCHEMBL13722960 0.77 KCNMA1 (0.44) KDM4ENPC1L3MBTL1KMT2ASMN1; SMN2
SCHEMBL13191549 0.77 KCNMA1 (0.54) KDM4ENPC1L3MBTL1KMT2ASMN1; SMN2
SCHEMBL12321787 0.77 KMT2A (0.56) NPC1KMT2ASMN1; SMN2KCNMA1TNKS
SCHEMBL22383440 0.75 NPC1 (0.46) KDM4ENPC1L3MBTL1KMT2ASMN1; SMN2
SCHEMBL22383444 0.74 NPC1 (0.44) KDM4ENPC1L3MBTL1KMT2ASMN1; SMN2
SCHEMBL19092972 0.74 KCNMA1 (0.61) NPC1KMT2ASMN1; SMN2KCNMA1MGAM
SCHEMBL2395074 0.74 KCNMA1 (0.49) NPC1KMT2ASMN1; SMN2KCNMA1MGAM
SCHEMBL12204565 0.74 SMN1; SMN2 (0.62) KDM4ENPC1L3MBTL1KMT2ASMN1; SMN2

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-2009143049-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND USE THEREOF AS GPR119 MODULATORS SCHERING CORPORATION (US) 2009-11-26 WO disclosed