SCHEMBL6236060

SCHEMBL6236060

c1coc(-c2nc3cncnc3nc2-c2ccco2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.56
MEN1 O00255 4/20 0.56
ALDH1A1 P00352 4/20 0.56
POLB P06746 4/20 0.56
MAPT P10636 4/20 0.56
KMT2A Q03164 4/20 0.56
KDM4E B2RXH2 3/20 0.56
HPGD P15428 3/20 0.56
PTPN7 P35236 3/20 0.56
RECQL P46063 3/20 0.56
BLM P54132 3/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
PKM P14618 2/20 0.56
ALOX15 P16050 2/20 0.56
CASP1 P29466 2/20 0.56
CASP7 P55210 2/20 0.56
HSD17B10 Q99714 2/20 0.56
TSHR P16473 1/20 0.56
THRB P10828 3/20 0.53
ALOX12 P18054 2/20 0.53

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
SCHEMBL6234984 0.77 MEN1 (0.65) TDP1MEN1ALDH1A1POLBMAPT
SCHEMBL6233715 0.75 PIK3R1 (0.63) TDP1MEN1ALDH1A1POLBMAPT
SCHEMBL6243217 0.75 PIK3R1 (0.63) TDP1MEN1ALDH1A1POLBMAPT
SCHEMBL27734202 0.73 MEN1 (1.00) TDP1MEN1ALDH1A1POLBMAPT
SCHEMBL3536096 0.73 PIK3CG (0.67) TDP1MEN1ALDH1A1KMT2AKDM4E
SCHEMBL2114343 0.72 MAPT (1.00) TDP1MEN1ALDH1A1POLBMAPT
SCHEMBL9352337 0.70 ALOX5 (0.51) TDP1MEN1ALDH1A1POLBMAPT
SCHEMBL3292267 0.70 PIK3CG (0.47) ALDH1A1HSD17B10TSHRPIK3CAPIK3CG
SCHEMBL6947886 0.69 ALOX5 (0.50) TDP1MEN1ALDH1A1POLBMAPT
SCHEMBL5425278 0.69 METAP2 (0.55) TDP1MEN1ALDH1A1POLBMAPT

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-2005007099-A2 PKB INHIBITORS AS ANTI-TUMOR AGENTS IMCLONE SYSTEMS INCORPORATED (US) 2005-01-27 WO disclosed