SCHEMBL10053396

SCHEMBL10053396

Cc1ccc(N(CC(=O)Nc2ccccc2-c2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.86

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.86
HPGD P15428 1/20 0.71
ATM Q13315 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
LMNA P02545 2/20 0.69
GAA P10253 1/20 0.69
OXTR P30559 5/20 0.67
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
AVPR1A P37288 2/20 0.56
ALDH1A1 P00352 1/20 0.54
MAPT P10636 2/20 0.54
TP53 P04637 1/20 0.53
KEAP1 Q14145 1/20 0.52
NFE2L2 Q16236 1/20 0.52
RORC P51449 1/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL806780 0.93 SMN1; SMN2 (1.00) SMN1; SMN2HPGDATML3MBTL1LMNA
SCHEMBL798403 0.89 OXTR (0.69) SMN1; SMN2HPGDATML3MBTL1LMNA
SCHEMBL806438 0.88 SMN1; SMN2 (0.83) SMN1; SMN2HPGDATML3MBTL1LMNA
SCHEMBL806760 0.83 SMN1; SMN2 (0.75) SMN1; SMN2HPGDATML3MBTL1LMNA
SCHEMBL3367904 0.80 OXTR (1.00) SMN1; SMN2HPGDATML3MBTL1GAA
SCHEMBL17340105 0.79 SMN1; SMN2 (0.68) SMN1; SMN2HPGDATML3MBTL1LMNA
SCHEMBL1632092 0.77 KEAP1 (0.86) LMNAMEN1KMT2AMAPTTP53
SCHEMBL798388 0.77 SMN1; SMN2 (0.71) SMN1; SMN2HPGDATML3MBTL1LMNA
SCHEMBL16557464 0.77 SMN1; SMN2 (0.71) SMN1; SMN2OXTRMEN1KMT2AALDH1A1
SCHEMBL6721085 0.76 RORC (0.62) SMN1; SMN2HPGDATML3MBTL1LMNA

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-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
WO-2012037119-A2 INHIBITORS OF VIRAL ENTRY INTO MAMMALIAN CELLS MICROBIOTIX, INC. (US) 2012-03-22 WO disclosed