SCHEMBL15313883

SCHEMBL15313883

CC(C)c1ccccc1NS(=O)(=O)c1ccc(NC(=O)c2cc(-c3nc4ccccc4s3)c(O)c(O)c2O)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.45
RXFP1 Q9HBX9 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
POLB P06746 3/20 0.44
BLM P54132 1/20 0.44
LMNA P02545 3/20 0.44
TP53 P04637 5/20 0.43
HPGD P15428 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
GAA P10253 1/20 0.42
BCL2 P10415 1/20 0.42
KDM4E B2RXH2 2/20 0.42
RAB9A P51151 2/20 0.42
PSMD14 O00487 1/20 0.42
NPC1 O15118 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42

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
SCHEMBL15313884 0.77 BCL2L1 (0.59) MAPTRXFP1SMN1; SMN2POLBBLM
SCHEMBL15313842 0.76 BCL2 (0.68) SMN1; SMN2LMNAHPGDALDH1A1MEN1
SCHEMBL15313835 0.76 CA12 (0.51) RXFP1SMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL15313838 0.75 BCL2 (0.66) SMN1; SMN2LMNAHPGDALDH1A1MEN1
SCHEMBL30116584 0.74 STING1 (0.55) MAPTRXFP1SMN1; SMN2POLBBLM
SCHEMBL15313846 0.73 BCL2 (0.57) MAPTLMNAHPGDALDH1A1MEN1
SCHEMBL3737205 0.72 LMNA (0.62) MAPTPOLBLMNATP53HPGD
SCHEMBL20110420 0.72 TP53 (0.60) SMN1; SMN2TP53MEN1KMT2A
SCHEMBL15313839 0.68 CA12 (0.53) MAPTSMN1; SMN2POLBLMNAHPGD
SCHEMBL6032487 0.67 MAPT (0.61) MAPTSMN1; SMN2POLBLMNATP53

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
US-8557812-B2 Small molecule inhibitors of anti-apoptotic BCL-2 family members and the uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2013-10-15 US disclosed
US-8557812-B2 Small molecule inhibitors of anti-apoptotic BCL-2 family members and the uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2013-10-15 US disclosed