SCHEMBL8559996

SCHEMBL8559996

COc1cccc(F)c1-c1oc(Cc2ccccc2)nc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 4/20 0.41
CDK9 P50750 4/20 0.41
PLK1 P53350 1/20 0.41
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
RPS6KA2 Q15349 2/20 0.40
SLC40A1 Q9NP59 2/20 0.39
EDNRA P25101 2/20 0.38
PIK3CD O00329 2/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
SCN9A Q15858 1/20 0.38
KAT7 O95251 1/20 0.38
KAT6B Q8WYB5 1/20 0.38
KAT6A Q92794 1/20 0.38
KAT5 Q92993 1/20 0.38
KAT8 Q9H7Z6 1/20 0.38
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL8556335 0.93 MAPT (0.44) MAPTALDH1A1SLC40A1EDNRAKAT7
SCHEMBL8557879 0.90 MAPT (0.44) MAPTALDH1A1SLC40A1
SCHEMBL8555336 0.88 MAPT (0.44) CCNT1CDK9MAPTALDH1A1SLC40A1
SCHEMBL8561042 0.87 MAPT (0.42) MAPTALDH1A1SLC40A1
SCHEMBL8556679 0.85 ALDH1A1 (0.46) CCNT1CDK9PLK1MAPTALDH1A1
SCHEMBL8559800 0.85 SLC40A1 (0.45) CCNT1CDK9MAPTALDH1A1SLC40A1
SCHEMBL8559481 0.84 ALDH1A1 (0.40) MAPTALDH1A1SLC40A1EDNRAPIK3CD
SCHEMBL8554227 0.83 CCNT1 (0.49) CCNT1CDK9MAPTALDH1A1SLC40A1
SCHEMBL8560735 0.83 PTGS2 (0.43) MAPTALDH1A1SLC40A1PIK3CDKAT7
SCHEMBL8556257 0.81 MAPT (0.46) MAPTALDH1A1SLC40A1

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