SCHEMBL365133

SCHEMBL365133

N#Cc1c2ccc(OC(=O)N3CCOCC3)cc2n2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.57
MEN1 O00255 5/20 0.57
KDM4E B2RXH2 4/20 0.57
ALDH1A1 P00352 3/20 0.57
L3MBTL1 Q9Y468 4/20 0.57
MAPK1 P28482 2/20 0.57
LMNA P02545 2/20 0.57
MAPT P10636 2/20 0.57
HTT P42858 2/20 0.57
NCOA3 Q9Y6Q9 2/20 0.57
CASP3 P42574 2/20 0.57
PABPC1 P11940 1/20 0.57
NCOA1 Q15788 1/20 0.57
SENP6 Q9GZR1 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
POLB P06746 1/20 0.53
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
TSHR P16473 2/20 0.49
EPHX1 P07099 2/20 0.48

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
SCHEMBL365667 0.83 EPHX1 (0.56) KMT2AMEN1KDM4EALDH1A1L3MBTL1
SCHEMBL365134 0.83 KMT2A (0.50) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL365100 0.82 EPHX1 (0.52) KMT2AMEN1KDM4EALDH1A1L3MBTL1
SCHEMBL365015 0.78 ALDH1A1 (0.58) KMT2AMEN1KDM4EALDH1A1LMNA
SCHEMBL365639 0.77 KMT2A (0.66) KMT2AMEN1KDM4EALDH1A1L3MBTL1
SCHEMBL366560 0.76 KDM4E (0.47) KMT2AMEN1KDM4EALDH1A1L3MBTL1
SCHEMBL366921 0.73 KDM4E (1.00) KMT2AMEN1KDM4EALDH1A1L3MBTL1
SCHEMBL366309 0.72 KDM4E (0.55) KMT2AMEN1KDM4EALDH1A1L3MBTL1
SCHEMBL367408 0.71 EPHX1 (0.51) KMT2AMEN1KDM4ECASP3POLB
SCHEMBL31323057 0.70 SMN1; SMN2 (0.88) KMT2AMEN1KDM4EALDH1A1MAPT

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-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed
WO-2012007008-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed