SCHEMBL8650243

SCHEMBL8650243

COc1cccc(C(=O)NS(=O)(=O)c2ccccc2C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 3/20 0.56
RAB9A P51151 6/20 0.56
NPC1 O15118 5/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
SMN1; SMN2 Q16637 4/20 0.53
LMNA P02545 2/20 0.52
KCNK3 O14649 2/20 0.51
KCNK9 Q9NPC2 2/20 0.51
TSHR P16473 2/20 0.51
KDM4E B2RXH2 1/20 0.51
TP53 P04637 1/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
PKM P14618 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HSP90AB1 P08238 1/20 0.50
MITF O75030 1/20 0.50
ALKBH2 Q6NS38 1/20 0.50

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
SCHEMBL9176062 0.83 LMNA (0.57) KAT6ARAB9ANPC1MEN1KMT2A
SCHEMBL3637063 0.81 LMNA (0.68) KAT6AMEN1KMT2ALMNAALKBH2
SCHEMBL9301023 0.81 LMNA (0.54) KAT6ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL28684587 0.81 LMNA (0.54) KAT6ARAB9ANPC1MEN1KMT2A
SCHEMBL28933292 0.81 LMNA (0.54) KAT6ALMNAALKBH2ALKBH3
SCHEMBL10772949 0.79 ALKBH2 (0.43) KAT6ALMNAALKBH2ALKBH3
SCHEMBL2172190 0.79 NPC1 (0.62) KAT6ARAB9ANPC1MEN1KMT2A
SCHEMBL31516646 0.78 KAT6A (0.55) KAT6ARAB9ANPC1MEN1KMT2A
SCHEMBL9303677 0.77 SMN1; SMN2 (0.60) MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL7986975 0.76 NPC1 (0.59) KAT6ARAB9ANPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0863873-A1 INDOLE CARBAMATES AS LEUKOTRIENE ANTAGONISTS PFIZER INC. (US) 1998-09-16 EP claimed
WO-1997013751-A1 INDOLE CARBAMATES AS LEUKOTRIENE ANTAGONISTS PFIZER INC. (US) 1997-04-17 WO claimed
CN-114059090-A Preparation method of benzo [ e ] [1,4,3] oxathiazine-1, 1-dioxide derivative 福州大学 2022-02-18 CN disclosed
EP-0748312-A1 BICYCLIC CARBAMATES AS LEUKOTRIENE D4 ANTAGONISTS PFIZER INC. (US) 1996-12-18 EP disclosed
WO-1995023789-A1 BICYCLIC CARBAMATES AS LEUKOTRIENE D4 ANTAGONISTS PFIZER INC. (US) 1995-09-08 WO disclosed
US-5439929-A Antagonist of leukotriene D4; blocking the leukotriene D4 receptor PFIZER INC. (US) 1995-08-08 US disclosed