SCHEMBL7147079

SCHEMBL7147079

CCOc1ccccc1S(=O)(=O)N(c1ccc(C)cc1)C(C)C(=O)NN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MAPT P10636 4/20 0.43
MEN1 O00255 2/20 0.43
HTT P42858 2/20 0.43
NPSR1 Q6W5P4 2/20 0.40
OXTR P30559 1/20 0.40
TSHR P16473 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HCRTR2 O43614 2/20 0.39
THRB P10828 1/20 0.38
KDM4E B2RXH2 1/20 0.38
KEAP1 Q14145 1/20 0.38

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
SCHEMBL3369941 0.81 OXTR (0.54) KMT2AMAPTOXTRTSHRLMNA
SCHEMBL3366190 0.81 OXTR (0.54) KMT2AMAPTOXTRTSHRLMNA
SCHEMBL7145996 0.78 MAPT (0.55) KMT2AMAPTMEN1HTTNPSR1
SCHEMBL3366811 0.67 KMT2A (0.47) KMT2AMAPTOXTRLMNAHCRTR2
SCHEMBL3369962 0.67 OXTR (0.55) KMT2AMAPTOXTRLMNAALDH1A1
SCHEMBL5644407 0.66 OXTR (0.57) KMT2AMAPTOXTRTSHRLMNA
SCHEMBL5675703 0.65 ALDH1A1 (0.51) KMT2AMAPTMEN1HTTNPSR1
SCHEMBL13588819 0.63 ALDH1A1 (0.44) KMT2AMAPTHTTNPSR1L3MBTL1
SCHEMBL419398 0.63 HSD17B10 (0.54) MAPTNPSR1L3MBTL1ALDH1A1HSD17B10
SCHEMBL29469832 0.63 CA1 (0.60) MAPTNPSR1L3MBTL1LMNACYP2C9

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
EP-1335901-A1 PHARMACEUTICALLY ACTIVE SULFANILIDE DERIVATIVES Applied Research Systems ARS Holding N.V. (AN) 2003-08-20 EP disclosed
WO-2002032864-A1 PHARMACEUTICALLY ACTIVE SULFANILIDE DERIVATIVES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2002-04-25 WO disclosed