SCHEMBL365335

SCHEMBL365335

COC(=O)c1c2ccccc2n2cc(C(=O)N3CCOCC3)ccc12

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.47
HPGD P15428 4/20 0.46
ALDH1A1 P00352 3/20 0.46
ALOX15 P16050 1/20 0.46
MGLL Q99685 1/20 0.46
HSD17B10 Q99714 1/20 0.46
RXFP1 Q9HBX9 2/20 0.46
KMT2A Q03164 7/20 0.44
MEN1 O00255 3/20 0.44
KDM4E B2RXH2 2/20 0.44
CNR1 P21554 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
THRB P10828 1/20 0.44
POLB P06746 1/20 0.43
RAB9A P51151 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
SCHEMBL367333 0.86 HPGD (0.52) CNR2HPGDALDH1A1KMT2AKDM4E
SCHEMBL365229 0.85 HPGD (0.48) CNR2HPGDALDH1A1KMT2AKDM4E
SCHEMBL366173 0.84 CNR1 (0.47) ALDH1A1ALOX15RXFP1KMT2AMEN1
SCHEMBL365334 0.83 L3MBTL1 (0.47) CNR2HPGDALDH1A1ALOX15MGLL
SCHEMBL364927 0.82 SRC (0.51) ALDH1A1KMT2AMEN1KDM4ETHRB
SCHEMBL366310 0.81 ALDH1A1 (0.52) HPGDALDH1A1HSD17B10KMT2AMEN1
SCHEMBL364339 0.80 KMT2A (0.49) ALDH1A1KMT2AMEN1KDM4ETHRB
SCHEMBL364281 0.80 NR4A2 (0.48) ALDH1A1KMT2AMEN1KDM4ETHRB
SCHEMBL364265 0.77 NR4A2 (0.46) ALDH1A1KMT2AMEN1KDM4ETHRB
SCHEMBL364450 0.77 KMT2A (0.47) ALDH1A1KMT2AMEN1KDM4EL3MBTL1

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-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-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