SCHEMBL13297294

SCHEMBL13297294

COc1ccc(-c2ccc(S(=O)(=O)c3ccc(C)cc3)cc2)cc1S(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ GAA P10253 3/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ ACLY P53396 1/20 0.43
▸ TP53 P04637 1/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ USP2 O75604 1/20 0.41
▸ PAX8 Q06710 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALPL P05186 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ HTR6 P50406 1/20 0.40
▸ CDC25A P30304 1/20 0.39
▸ CDC25B P30305 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ NR1I2 O75469 1/20 0.39

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
SCHEMBL12736416 0.94 HTT (0.50) TSHRPOLBMAPK1GAASMN1; SMN2
SCHEMBL10138722 0.91 SMN1; SMN2 (0.47) TSHRPOLBMAPK1GAASMN1; SMN2
SCHEMBL12736446 0.90 SMN1; SMN2 (0.44) TSHRPOLBMAPK1GAASMN1; SMN2
SCHEMBL12276812 0.90 TSHR (0.54) TSHRPOLBMAPK1GAASMN1; SMN2
SCHEMBL24977924 0.89 SMN1; SMN2 (0.45) TSHRPOLBMAPK1GAASMN1; SMN2
SCHEMBL17169232 0.88 HTT (0.50) TSHRPOLBMAPK1GAASMN1; SMN2
SCHEMBL20370948 0.87 PKM (0.46) TSHRGAASMN1; SMN2HTTNR1I2
SCHEMBL17172538 0.85 POLB (0.44) TSHRPOLBMAPK1GAASMN1; SMN2
SCHEMBL13297310 0.84 GSK3B (0.48) TSHRPOLBMAPK1GAASMN1; SMN2
SCHEMBL17169295 0.83 HTT (0.54) TSHRPOLBMAPK1GAASMN1; SMN2

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-7736539-B2 Ion-conducting polymers and membranes comprising them JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2010-06-15 — — US disclosed
EP-1704175-B1 ION-CONDUCTING POLYMERS AND MEMBRANES COMPRISING THEM JOHNSON MATTHEY PLC (GB) 2008-10-15 — — EP disclosed
US-20070196734-A1 Ion-Conducting Polymers And Membranes Comprising Them Johnson Matthey Hydrogen Technologies Limited (GB) 2007-08-23 — — US disclosed
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