SCHEMBL6702547

SCHEMBL6702547

CC1C(=O)N(c2ccccc2Cl)C(=S)N1c1ccc(N2CCOCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.49
MAPT P10636 7/20 0.49
HSD17B10 Q99714 4/20 0.49
RAD51 Q06609 2/20 0.49
PKM P14618 2/20 0.49
POLB P06746 1/20 0.49
TP53 P04637 1/20 0.47
AKR1C3 P42330 1/20 0.43
KIF11 P52732 1/20 0.43
GAA P10253 4/20 0.41
ALOX12 P18054 4/20 0.41
ALOX15 P16050 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPK1 P28482 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
PIK3C3 Q8NEB9 2/20 0.41
USP2 O75604 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL6704568 0.87 KIF11 (0.44) ALDH1A1MAPTHSD17B10POLBAKR1C3
SCHEMBL6701945 0.86 ALDH1A1 (0.56) ALDH1A1MAPTHSD17B10KIF11GAA
SCHEMBL6702824 0.84 KIF11 (0.53) ALDH1A1MAPTRAD51PKMPOLB
SCHEMBL6704097 0.84 KIF11 (0.53) ALDH1A1MAPTRAD51PKMPOLB
SCHEMBL6702073 0.83 RAD51 (0.49) ALDH1A1MAPTRAD51AKR1C3KIF11
SCHEMBL6704444 0.82 ALDH1A1 (0.51) ALDH1A1MAPTHSD17B10PKMPOLB
SCHEMBL6703556 0.79 MAPT (0.46) ALDH1A1MAPTHSD17B10AKR1C3KIF11
SCHEMBL6703729 0.79 PARP1 (0.42) ALDH1A1MAPTHSD17B10POLBTP53
SCHEMBL6699022 0.79 KIF11 (0.54) ALDH1A1MAPTHSD17B10POLBKIF11
SCHEMBL6627356 0.78 MAPT (0.44) ALDH1A1MAPTHSD17B10RAD51PKM

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
US-20040116417-A1 Thiohydantoins and use thereof for treating diabetes LABORATOIRES FOURNIER SA (FR) 2004-06-17 US disclosed