SCHEMBL367332

SCHEMBL367332

O=C(O)c1c2ccc(C(=O)N3CCOCC3)cc2n2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.50
CNR1 P21554 1/20 0.49
TSHR P16473 1/20 0.47
PKM P14618 2/20 0.46
CNR2 P34972 1/20 0.46
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
CDK5 Q00535 1/20 0.44
CDK5R1 Q15078 1/20 0.44
MYC P01106 1/20 0.44
POLB P06746 1/20 0.43
DNMT1 P26358 1/20 0.43
PTPN7 P35236 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL365228 0.90 HPGD (0.47) HPGDCNR1TSHRPKMCNR2
SCHEMBL365334 0.87 L3MBTL1 (0.47) HPGDCNR1PKMCNR2ALDH1A1
SCHEMBL367333 0.81 HPGD (0.52) HPGDCNR1TSHRCNR2GAA
SCHEMBL365667 0.81 EPHX1 (0.56) TSHRGAASMN1; SMN2ALDH1A1KDM4E
SCHEMBL365934 0.81 KDM4E (0.45) HPGDGAAALDH1A1KDM4EKMT2A
SCHEMBL366810 0.79 PTGS2 (0.45) TSHRSMN1; SMN2ALDH1A1KDM4EPOLB
SCHEMBL366309 0.78 KDM4E (0.55) HPGDCNR1CNR2SMN1; SMN2ALDH1A1
SCHEMBL366875 0.77 EGFR (0.42) HPGDALDH1A1KDM4ENPC1RAB9A
SCHEMBL365911 0.74 CES1 (0.42) ALDH1A1KDM4EKMT2A
SCHEMBL366370 0.74 EGFR (0.43) ALDH1A1KDM4EKMT2A

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