SCHEMBL6239309

SCHEMBL6239309

Fc1cc2nc(-c3cccs3)c(-c3cccs3)nc2cc1F

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KB2 Q9UBS0 8/20 0.70
SRPK1 Q96SB4 1/20 0.53
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
LMNA P02545 2/20 0.45
CASP1 P29466 2/20 0.45
CASP7 P55210 2/20 0.45
HSD17B10 Q99714 2/20 0.45
GLA P06280 1/20 0.45
MAPT P10636 5/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
KDM4E B2RXH2 4/20 0.45
ALDH1A1 P00352 3/20 0.45
HTT P42858 1/20 0.45
HPGD P15428 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ADORA2A P29274 2/20 0.44
ATM Q13315 1/20 0.44

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
SCHEMBL6234970 0.88 RPS6KB2 (0.60) RPS6KB2SRPK1NPC1RAB9ALMNA
SCHEMBL7692571 0.82 RPS6KB2 (1.00) RPS6KB2SRPK1NPC1RAB9ALMNA
SCHEMBL6236081 0.81 RPS6KB2 (0.70) RPS6KB2SRPK1NPC1RAB9ALMNA
SCHEMBL6243113 0.81 RPS6KB2 (0.70) RPS6KB2SRPK1NPC1RAB9ALMNA
SCHEMBL16027135 0.79 RPS6KB2 (0.74) RPS6KB2SRPK1NPC1RAB9ALMNA
SCHEMBL31393470 0.79 RPS6KB2 (0.74) RPS6KB2SRPK1NPC1RAB9ALMNA
SCHEMBL23724046 0.79 RPS6KB2 (0.68) RPS6KB2SRPK1NPC1RAB9ALMNA
SCHEMBL19066635 0.78 RPS6KB2 (0.71) RPS6KB2SRPK1NPC1RAB9ALMNA
SCHEMBL6233558 0.78 RPS6KB2 (0.51) RPS6KB2SRPK1NPC1RAB9ALMNA
SCHEMBL6234080 0.77 RPS6KB2 (0.64) RPS6KB2SRPK1NPC1RAB9ALMNA

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