SCHEMBL15922175

SCHEMBL15922175

NC(=O)c1ccc(C(=O)Nc2ccccc2S(=O)(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
PDCD1 Q15116 1/20 0.50
CD274 Q9NZQ7 1/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HDAC3 O15379 3/20 0.46
HDAC1 Q13547 3/20 0.46
HDAC2 Q92769 3/20 0.46
MAPK1 P28482 1/20 0.46
NCOR2 Q9Y618 1/20 0.45
CD40 P25942 2/20 0.44
CD40LG P29965 2/20 0.44
F10 P00742 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
PTGS1 P23219 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL31520127 0.87 MDM4 (0.56) CA1CA2MEN1KMT2AHDAC3
SCHEMBL2893166 0.87 MDM4 (0.56) CA1CA2MEN1KMT2AHDAC3
SCHEMBL6241585 0.83 TIMP3 (0.56) CA1CA2MEN1KMT2AHDAC3
SCHEMBL31520132 0.82 CA1 (0.55) CA1CA2KMT2AHDAC3HDAC1
SCHEMBL7297478 0.81 CA1 (0.50) CA1CA2CA9
SCHEMBL12669228 0.81 CA1 (0.50) CA1CA2MEN1KMT2AHDAC3
SCHEMBL27502345 0.80 CA1 (0.49) CA1CA2CA9
SCHEMBL10035663 0.80 SENP8 (0.55) CA1CA2KMT2AHDAC3HDAC1
SCHEMBL11797457 0.80 NPC1 (0.66) MEN1KMT2ACD40CD40LGNPC1
SCHEMBL1664024 0.78 MEN1 (0.59) PDCD1CD274MEN1KMT2AHDAC3

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-20140320961-A1 OPTICAL FILM CRYSOPTIX KK (JP) 2014-10-30 US disclosed
WO-2014120505-A2 OPTICAL FILM CRYSOPTIX KK (JP) 2014-08-07 WO disclosed