SCHEMBL530857

SCHEMBL530857

CNC(=O)c1ccccc1NS(C)(=O)=O

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.68
TSHR P16473 3/20 0.63
ALDH1A1 P00352 11/20 0.62
KDM4E B2RXH2 9/20 0.62
HPGD P15428 6/20 0.62
HSD17B10 Q99714 6/20 0.62
RCE1 Q9Y256 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.60
HTT P42858 2/20 0.60
MEN1 O00255 2/20 0.60
PKM P14618 1/20 0.55
MAPK1 P28482 1/20 0.55
ATM Q13315 1/20 0.51
NR3C1 P04150 1/20 0.51
GAA P10253 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
SCHEMBL1638701 0.84 ALDH1A1 (0.62) KMT2ATSHRALDH1A1KDM4EHPGD
SCHEMBL8889074 0.83 KMT2A (0.80) KMT2ATSHRALDH1A1KDM4EHPGD
SCHEMBL9624375 0.81 KMT2A (0.67) KMT2ATSHRALDH1A1KDM4EHPGD
SCHEMBL220059 0.81 KMT2A (0.72) KMT2ATSHRALDH1A1KDM4EHPGD
SCHEMBL19221685 0.81 HTT (0.72) KMT2ATSHRALDH1A1KDM4EHPGD
SCHEMBL2450123 0.81 TSHR (0.58) KMT2ATSHRALDH1A1KDM4EHPGD
SCHEMBL11708769 0.81 KMT2A (1.00) KMT2ATSHRALDH1A1KDM4EHPGD
SCHEMBL11123377 0.80 CA2 (0.50) KMT2ATSHRALDH1A1KDM4EHPGD
SCHEMBL14856070 0.80 TSHR (0.74) KMT2ATSHRALDH1A1KDM4EHPGD
SCHEMBL8006673 0.80 KMT2A (0.65) KMT2ATSHRALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012014127-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO claimed
WO-2012014127-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO disclosed
EP-2203430-A1 N-PHENYL-DIOXO-HYDROPYRIMIDINES USEFUL AS HEPATITIS C VIRUS (HCV) INHIBITORS Abbott Laboratories (US) 2010-07-07 EP disclosed
WO-2009039135-A1 N-PHENYL-DIOXO-HYDROPYRIMIDINES USEFUL AS HEPATITIS C VIRUS (HCV) INHIBITORS ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed