SCHEMBL8560392

SCHEMBL8560392

O=S(=O)(Nc1nc(Cc2ccccc2)oc1-c1c(Cl)cccc1Cl)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 3/20 0.43
RXFP1 Q9HBX9 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 4/20 0.42
PGR P06401 1/20 0.42
GAA P10253 2/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
SLC40A1 Q9NP59 3/20 0.39
FBP1 P09467 1/20 0.38
PIK3C2B O00750 1/20 0.38
PIK3C2G O75747 1/20 0.38
LIMK2 P53671 1/20 0.38
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
HTR6 P50406 2/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL8559268 0.92 MAPT (0.42) MAPTALDH1A1KDM4ERXFP1NPSR1
SCHEMBL8555336 0.90 MAPT (0.44) MAPTALDH1A1KDM4ERXFP1NPSR1
SCHEMBL8559341 0.88 MAPT (0.44) MAPTALDH1A1KDM4ERXFP1NPSR1
SCHEMBL8557879 0.86 MAPT (0.44) MAPTALDH1A1KDM4ERXFP1NPSR1
SCHEMBL8556257 0.86 MAPT (0.46) MAPTALDH1A1KDM4ENPSR1LMNA
SCHEMBL8555536 0.86 ALDH1A1 (0.42) MAPTALDH1A1KDM4ERXFP1NPSR1
SCHEMBL8556039 0.85 MAPT (0.44) MAPTALDH1A1KDM4ERXFP1NPSR1
SCHEMBL8557471 0.84 MAPT (0.48) MAPTALDH1A1KDM4ERXFP1NPSR1
SCHEMBL8560337 0.84 MAPT (0.50) MAPTALDH1A1KDM4ERXFP1NPSR1
SCHEMBL8553792 0.83 MAPT (0.40) MAPTALDH1A1KDM4ERXFP1NPSR1

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-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed