SCHEMBL13670312

SCHEMBL13670312

CCc1ccc(C(=O)c2ccc(Oc3ccc(S(=O)(=O)c4ccc(C)cc4)cc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
HTT P42858 3/20 0.55
MAPT P10636 2/20 0.51
TP53 P04637 1/20 0.51
THRB P10828 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
PTGES O14684 1/20 0.47
ALOX5 P09917 1/20 0.47
GFER P55789 1/20 0.47
MAPK14 Q16539 1/20 0.45
GAA P10253 2/20 0.45
KMT2A Q03164 2/20 0.45
SRD5A2 P31213 2/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 2/20 0.44
MMP13 P45452 1/20 0.44
POLB P06746 2/20 0.44
PKM P14618 1/20 0.44
P2RY14 Q15391 1/20 0.44

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
SCHEMBL13670311 1.00 SMN1; SMN2 (0.55) SMN1; SMN2HTTMAPTTP53THRB
SCHEMBL26529479 0.90 HTT (0.56) SMN1; SMN2HTTMAPTTP53THRB
SCHEMBL13670313 0.90 ALDH1A1 (0.55) SMN1; SMN2HTTMAPK14KMT2ASRD5A2
SCHEMBL21572691 0.90 HTT (0.67) SMN1; SMN2HTTMAPTL3MBTL1TDP1
SCHEMBL822651 0.90 HTT (0.67) SMN1; SMN2HTTMAPTL3MBTL1TDP1
SCHEMBL822865 0.90 HTT (0.67) SMN1; SMN2HTTMAPTL3MBTL1TDP1
SCHEMBL13670310 0.90 ALDH1A1 (0.55) SMN1; SMN2HTTMAPK14KMT2ASRD5A2
SCHEMBL10030476 0.90 HTT (0.67) SMN1; SMN2HTTMAPTL3MBTL1TDP1
SCHEMBL12769554 0.90 HTT (0.67) SMN1; SMN2HTTMAPTL3MBTL1TDP1
SCHEMBL16995928 0.90 ALDH1A1 (0.55) SMN1; SMN2HTTMAPK14KMT2ASRD5A2

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-2278051-B1 Improved fabrics SOLVAY SPECIALTY POLYMERS USA (US) 2012-12-05 EP disclosed
US-20090269645-A1 POLYMER, POLYMER ELECTROLYTE AND FUEL CELL USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-29 US disclosed