SCHEMBL798762

SCHEMBL798762

COc1ccc(S(=O)(=O)N(CC(=O)Nc2ccccc2-c2ccccc2)c2ccccc2OC)cc1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.67
HPGD P15428 3/20 0.64
ALDH1A1 P00352 3/20 0.64
HTT P42858 2/20 0.64
SMN1; SMN2 Q16637 4/20 0.62
LMNA P02545 3/20 0.62
GAA P10253 3/20 0.62
TP53 P04637 1/20 0.59
NPSR1 Q6W5P4 2/20 0.59
USP2 O75604 1/20 0.59
TSHR P16473 1/20 0.59
ATM Q13315 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
MAPK1 P28482 1/20 0.57

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
SCHEMBL806760 0.89 SMN1; SMN2 (0.75) MAPTHPGDHTTSMN1; SMN2LMNA
SCHEMBL17340105 0.86 SMN1; SMN2 (0.68) MAPTHPGDALDH1A1HTTSMN1; SMN2
SCHEMBL806438 0.85 SMN1; SMN2 (0.83) MAPTHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL798403 0.84 OXTR (0.69) MAPTHPGDHTTSMN1; SMN2LMNA
SCHEMBL15583931 0.82 MAPT (0.75) MAPTHPGDTSHR
SCHEMBL18101489 0.81 SMN1; SMN2 (0.70) MAPTHPGDALDH1A1HTTSMN1; SMN2
SCHEMBL1629150 0.80 KEAP1 (0.77)
SCHEMBL16557468 0.78 HPGD (0.81) MAPTHPGDALDH1A1HTTSMN1; SMN2
SCHEMBL16557596 0.78 MAPT (0.69) MAPTHPGDTP53
SCHEMBL16557554 0.78 MAPT (0.72) MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9212134-B2 Inhibitors of viral entry into mammalian cells MICROBIOTIX, INC. (US) 2015-12-15 US disclosed
CN-103491956-A Inhibitors of viral entry into mammalian cells MICROBIOTIX INC 2014-01-01 CN disclosed
EP-2616073-A2 INHIBITORS OF VIRAL ENTRY INTO MAMMALIAN CELLS Microbiotix, Inc. (US) 2013-07-24 EP disclosed
WO-2012037119-A2 INHIBITORS OF VIRAL ENTRY INTO MAMMALIAN CELLS MICROBIOTIX, INC. (US) 2012-03-22 WO disclosed
WO-2012037119-A2 INHIBITORS OF VIRAL ENTRY INTO MAMMALIAN CELLS MICROBIOTIX, INC. (US) 2012-03-22 WO disclosed