SCHEMBL4878079

SCHEMBL4878079

Cc1ccc(C=C(C#N)C(N)=S)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.70
ALDH1A1 P00352 9/20 0.70
GAA P10253 3/20 0.70
HTT P42858 1/20 0.70
ATM Q13315 1/20 0.70
KMT2A Q03164 8/20 0.69
KDM4E B2RXH2 6/20 0.69
HPGD P15428 5/20 0.69
TDP1 Q9NUW8 7/20 0.64
MEN1 O00255 7/20 0.63
MAPK1 P28482 3/20 0.63
NPSR1 Q6W5P4 3/20 0.63
L3MBTL1 Q9Y468 3/20 0.63
RECQL P46063 4/20 0.61
BLM P54132 3/20 0.61
APEX1 P27695 2/20 0.61
PMP22 Q01453 2/20 0.61
RGS12 O14924 2/20 0.61
ERBB2 P04626 2/20 0.61
CYP1A2 P05177 2/20 0.61

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
SCHEMBL4879813 0.82 MAPT (0.70) MAPTALDH1A1GAAHTTATM
SCHEMBL32688435 0.82 MAPT (0.70) MAPTALDH1A1GAAHTTATM
SCHEMBL4879772 0.82 MAPT (0.70) MAPTALDH1A1GAAHTTATM
SCHEMBL19928344 0.81 MAPT (0.69) MAPTALDH1A1GAAHTTATM
SCHEMBL4875635 0.81 MAPT (0.64) MAPTALDH1A1GAAHTTATM
SCHEMBL32688162 0.79 MAPT (0.66) MAPTALDH1A1GAAHTTATM
SCHEMBL32688074 0.78 MAPT (0.64) MAPTALDH1A1GAAHTTATM
SCHEMBL32687969 0.78 ALDH1A1 (0.64) MAPTALDH1A1GAAHTTATM
SCHEMBL16295735 0.78 ALDH1A1 (0.67) MAPTALDH1A1GAAHTTATM
SCHEMBL16295736 0.78 ALDH1A1 (0.67) MAPTALDH1A1GAAHTTATM

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-20080171440-A1 Pre-polishing treatment solution for interconnect substrate, polishing method, and method and apparatus for manufacturing interconnect substrate EBARA CORPORATION (JP) 2008-07-17 US disclosed