SCHEMBL19632244

SCHEMBL19632244

Cc1ccc(S(=O)(=O)c2ccc(-c3ccc(S(=O)(=O)c4ccc(Oc5ccc(C(C)(C)c6ccc(OC(C)(C)C)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
GAA P10253 1/20 0.43
ALDH1A1 P00352 5/20 0.39
FFAR1 O14842 1/20 0.38
HSD11B1 P28845 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
BCHE P06276 2/20 0.38
ACHE P22303 2/20 0.38
ELANE P08246 1/20 0.37
PKM P14618 2/20 0.37
PTGS1 P23219 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
PTGS2 P35354 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL16221627 0.93 HTT (0.61) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL18801604 0.90 ALDH1A1 (0.41) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL18801817 0.90 ALDH1A1 (0.41) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL18807703 0.90 ALDH1A1 (0.41) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL12606796 0.89 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL12769543 0.89 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL822791 0.89 HTT (0.67) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL4548600 0.88 HTT (0.55) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL12305031 0.88 HTT (0.55) HTTSMN1; SMN2TDP1L3MBTL1GAA
SCHEMBL686036 0.88 HTT (0.55) HTTSMN1; SMN2TDP1L3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170333849-A1 COPOLYMERS FOR MAKING MEMBRANES BASF SE (DE) 2017-11-23 US disclosed