SCHEMBL366176

SCHEMBL366176

COC(=O)c1c2c(C)cc(C(=O)N3CCOCC3)cc2n2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
HPGD P15428 4/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
RAB9A P51151 1/20 0.42
GLA P06280 1/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
ALOX15 P16050 1/20 0.40
MGLL Q99685 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PKM P14618 1/20 0.40
GRM5 P41594 1/20 0.40
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL365334 0.83 L3MBTL1 (0.47) L3MBTL1HPGDKMT2AMEN1RAB9A
SCHEMBL366172 0.73 ALDH1A1 (0.47) KMT2AMEN1ALDH1A1KDM4EPOLB
SCHEMBL365335 0.72 CNR2 (0.47) L3MBTL1HPGDKMT2AMEN1RAB9A
SCHEMBL367332 0.72 HPGD (0.50) L3MBTL1HPGDKMT2ARAB9AALDH1A1
SCHEMBL366309 0.71 KDM4E (0.55) L3MBTL1HPGDKMT2AMEN1RAB9A
SCHEMBL365228 0.71 HPGD (0.47) HPGDKMT2AMEN1RAB9AKDM4E
SCHEMBL4206984 0.69 L3MBTL1 (0.70) L3MBTL1HPGDKMT2AMEN1RAB9A
SCHEMBL7422569 0.68 HPGD (0.74) L3MBTL1HPGDKMT2AMEN1RAB9A
SCHEMBL366113 0.67 EPHX1 (0.49) L3MBTL1KMT2AMEN1RAB9AKDM4E
SCHEMBL364926 0.67 MAPT (0.49) L3MBTL1HPGDKMT2AMEN1ALDH1A1

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