SCHEMBL8720077

SCHEMBL8720077

Cc1ccccc1S(=O)(=O)NC1CCc2sc(-c3ccc(=O)[nH]n3)cc2C1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.39
POLB P06746 5/20 0.38
BRD4 O60885 3/20 0.37
MEN1 O00255 5/20 0.36
SLC26A4 O43511 1/20 0.35
PKM P14618 2/20 0.35
RAB9A P51151 2/20 0.35
CASP6 P55212 1/20 0.34
LMNA P02545 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
NR1H2 P55055 1/20 0.34
PNMT P11086 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
GFER P55789 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL9383997 0.81 NR1H2 (0.35) KMT2APOLBBRD4MEN1SLC26A4
SCHEMBL8715129 0.73 CA1 (0.41) KMT2APOLBBRD4PKMLMNA
SCHEMBL8720708 0.71 TBXA2R (0.41) KMT2AMEN1RAB9ALMNANR1H2
SCHEMBL7777861 0.67 POLB (0.43) KMT2APOLBBRD4MEN1PKM
SCHEMBL10405894 0.67 CA1 (0.54) KMT2APOLBBRD4MEN1PKM
SCHEMBL9414927 0.67 PNMT (0.40) PKMPNMTSMN1; SMN2
SCHEMBL2807827 0.66 PAK1 (0.36) KMT2APOLBBRD4PKMLMNA
SCHEMBL13468496 0.66 ALDH1A1 (0.56) KMT2APOLBBRD4MEN1PKM
SCHEMBL8715076 0.64 BRD4 (0.34) KMT2APOLBBRD4MEN1PKM
SCHEMBL4623414 0.62 BRD4 (0.55) KMT2APOLBBRD4MEN1PKM

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-5739132-A ENDOTHOXIN SHOCK; NEPHRITIS TANABE SEIYAKU CO., LTD. (JP) 1998-04-14 US disclosed
EP-0579059-A1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1994-01-19 EP disclosed