SCHEMBL3673727

SCHEMBL3673727

O=S(=O)(Nc1ccc2ccccc2c1)Oc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.60
LMNA P02545 1/20 0.60
CA1 P00915 3/20 0.59
CA2 P00918 3/20 0.59
PGR P06401 1/20 0.55
CA9 Q16790 2/20 0.49
CA12 O43570 1/20 0.49
SLC40A1 Q9NP59 1/20 0.49
AKR1C3 P42330 1/20 0.48
PKM P14618 1/20 0.48
PKLR P30613 1/20 0.48
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
CYP3A4 P08684 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ATM Q13315 1/20 0.46
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
MAPT P10636 3/20 0.46
HTT P42858 2/20 0.46

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
SCHEMBL10417826 0.87 CA2 (0.57) SMN1; SMN2LMNACA1CA2PGR
SCHEMBL1729178 0.81 KMT2A (0.53) LMNACA1CA2PGRCA9
SCHEMBL3678785 0.81 CA1 (0.61) SMN1; SMN2LMNACA1CA2PGR
SCHEMBL10325170 0.80 KMT2A (0.52) LMNACA1CA2PGRCA9
SCHEMBL28166872 0.77 KEAP1 (0.56) CA1CA2PGRCA9CA12
SCHEMBL14582134 0.77 NPSR1 (0.49) SMN1; SMN2LMNASLC40A1ALDH1A1HPGD
SCHEMBL28851454 0.76 MEN1 (0.43) SMN1; SMN2LMNACA1CA2PGR
SCHEMBL2614387 0.75 SMN1; SMN2 (1.00) SMN1; SMN2LMNACA1CA2PGR
SCHEMBL3202501 0.74 CA2 (0.67) SMN1; SMN2LMNACA1CA2PGR
SCHEMBL30186176 0.74 CA1 (0.67) SMN1; SMN2LMNACA1CA2PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100233610-A1 POLYMER HAVING A SULFONIC GROUP OR A SULFONATE GROUP AND AN AMIDE GROUP AND METHOD OF PRODUCING SAME CANON KABUSHIKI KAISHA (JP) 2010-09-16 US disclosed
EP-1749035-A2 POLYMER HAVING A SULFONIC GROUP OR A SULFONATE GROUP AND AN AMIDE GROUP AND METHOD OF PRODUCING SAME Canon Kabushiki Kaisha (JP) 2007-02-07 EP disclosed
WO-2005108441-A2 POLYMER HAVING A SULFONIC GROUP OR A SULFONATE GROUP AND AN AMIDE GROUP AND METHOD OF PRODUCING SAME CANON KABUSHIKI KAISHA (JP) 2005-11-17 WO disclosed