SCHEMBL6231884

SCHEMBL6231884

Cc1cc(C(=O)CN(CC(=O)O)C(=O)OC(C)(C)C)c2ccccc2n1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.47
NPC1 O15118 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 2/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 3/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL6229677 0.81 KDM4E (0.43) KDM4ENPC1MEN1KMT2AALDH1A1
SCHEMBL30201917 0.77 KDM4E (0.62) KDM4EL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL15876138 0.77 KDM4E (0.62) KDM4EL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL6231398 0.76 MGAM (0.44) KDM4EL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL6226886 0.75 NPC1 (0.51) NPC1L3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL28877512 0.74 L3MBTL1 (0.58) KDM4EL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL6227192 0.73 EGLN1 (0.41) L3MBTL1
SCHEMBL28536559 0.72 L3MBTL1 (0.60) KDM4ENPC1L3MBTL1MEN1KMT2A
SCHEMBL10390303 0.70 HTT (0.52) KDM4ENPC1L3MBTL1MEN1KMT2A
SCHEMBL78691 0.70 CA14 (0.41) KDM4EL3MBTL1MEN1KMT2AGAA

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
EP-1595866-A1 COMPOUND INHIBITING DIPEPTIDYL PEPTIDASE IV Sanwa Kagaku Kenkyusho Co., Ltd. (JP) 2005-11-16 EP disclosed