SCHEMBL8716698

SCHEMBL8716698

COc1ccccc1NS(=O)(=O)c1ccc(CO)cc1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.65
HTT P42858 1/20 0.64
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
LIMK2 P53671 1/20 0.60
NAMPT P43490 1/20 0.56
ALDH1A1 P00352 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
GAA P10253 2/20 0.55
KDM4E B2RXH2 1/20 0.55
HSD17B10 Q99714 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54

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
SCHEMBL8752511 0.87 POLB (0.63) POLBHTTMEN1KMT2ALIMK2
SCHEMBL5459200 0.85 ALDH1A1 (0.66) POLBHTTMEN1KMT2ALIMK2
SCHEMBL1138968 0.83 METAP2 (0.52) POLBHTTMEN1KMT2ALIMK2
SCHEMBL3380247 0.83 POLB (0.68) POLBHTTMEN1KMT2AALDH1A1
SCHEMBL7572319 0.82 POLB (0.68) POLBHTTMEN1KMT2AALDH1A1
SCHEMBL789616 0.82 KEAP1 (0.72) POLBHTTMEN1KMT2AALDH1A1
SCHEMBL7571620 0.82 POLB (0.68) POLBHTTMEN1KMT2AALDH1A1
SCHEMBL6976064 0.81 ALDH1A1 (0.60) MEN1KMT2ANAMPTALDH1A1KDM4E
SCHEMBL2246137 0.81 POLB (0.70) POLBHTTMEN1KMT2AALDH1A1
SCHEMBL7586724 0.81 NPC1 (0.68) POLBHTTMEN1KMT2AALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5728835-A HYPOTENSIVE AGENTS; ANTIISCHEMIC AGENTS TOA EIYO, LTD. (JP) 1998-03-17 US disclosed
EP-0661266-A1 Substituted cyclic amine compounds as 5HT2 antagonists TOA EIYO LTD. (JP) 1995-07-05 EP disclosed