SCHEMBL8863706

SCHEMBL8863706

Cc1ccc(S(=O)(=O)OCCCCCCCCCCCCCCCC(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
TSHR P16473 1/20 0.44
TBXAS1 P24557 2/20 0.44
LTB4R Q15722 1/20 0.43
ALDH1A1 P00352 6/20 0.43
KMT2A Q03164 2/20 0.43
RAB9A P51151 1/20 0.43
PSMD10 O75832 1/20 0.43
PPARG P37231 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL9764712 1.00 STAT3 (0.46) STAT3L3MBTL1TSHRTBXAS1LTB4R
SCHEMBL10449020 1.00 STAT3 (0.46) STAT3L3MBTL1TSHRTBXAS1LTB4R
SCHEMBL30850377 1.00 STAT3 (0.46) STAT3L3MBTL1TSHRTBXAS1LTB4R
SCHEMBL8864017 1.00 STAT3 (0.46) STAT3L3MBTL1TSHRTBXAS1LTB4R
SCHEMBL17614843 1.00 STAT3 (0.46) STAT3L3MBTL1TSHRTBXAS1LTB4R
SCHEMBL9458218 1.00 STAT3 (0.46) STAT3L3MBTL1TSHRTBXAS1LTB4R
SCHEMBL25030574 1.00 STAT3 (0.46) STAT3L3MBTL1TSHRTBXAS1LTB4R
SCHEMBL7827739 1.00 STAT3 (0.46) STAT3L3MBTL1TSHRTBXAS1LTB4R
SCHEMBL6238329 0.98 STAT3 (0.47) STAT3L3MBTL1TSHRTBXAS1LTB4R
SCHEMBL17951934 0.96 TBXA2R (0.43) STAT3L3MBTL1TSHRTBXAS1LTB4R

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0525479-B1 Spicamycin derivatives and the use thereof KIRIN BREWERY (JP) 1997-11-05 EP disclosed
US-5631238-A ANTICARCINOGENIC AGENTS KIRIN BEER KABUSHIKI KAISHA (JP) 1997-05-20 US disclosed
US-5461036-A Treating colon, gastric, esophageal cancer KIRIN BEER KABUSHIKI KAISHA (JP) 1995-10-24 US disclosed
EP-0525479-A1 Spicamycin derivatives and the use thereof KIRIN BEER KABUSHIKI KAISHA (JP) 1993-02-03 EP disclosed