SCHEMBL9303424

SCHEMBL9303424

Cc1ccc(S(=O)(=O)c2ccc(Oc3ccc(O)c(C(=O)O)c3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
L3MBTL1 Q9Y468 3/20 0.57
CYP2C9 P11712 2/20 0.57
CYP1A2 P05177 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
CYP2C19 P33261 1/20 0.54
POLB P06746 1/20 0.53
APEX1 P27695 1/20 0.53
CTDSP1 Q9GZU7 1/20 0.53
CSNK2A1 P68400 1/20 0.53
MCL1 Q07820 7/20 0.51
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.48
GFER P55789 1/20 0.47
BCL2L1 Q07817 3/20 0.47
XDH P47989 1/20 0.46
GAA P10253 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
SCHEMBL9304104 0.91 L3MBTL1 (0.58) HTTSMN1; SMN2L3MBTL1CYP2C9CYP1A2
SCHEMBL9304667 0.89 HTT (0.59) HTTSMN1; SMN2L3MBTL1CYP2C9CYP1A2
SCHEMBL9304588 0.89 POLB (0.56) HTTSMN1; SMN2L3MBTL1CYP2C9CYP1A2
SCHEMBL19318193 0.85 HTT (0.57) HTTSMN1; SMN2L3MBTL1CYP2C9CYP1A2
SCHEMBL345493 0.82 MEN1 (0.57) HTTL3MBTL1CYP2C9CYP1A2CTDSP1
SCHEMBL9304480 0.81 HTT (0.58) HTTSMN1; SMN2L3MBTL1CYP2C9CYP1A2
SCHEMBL9304326 0.81 POLB (0.50) HTTSMN1; SMN2L3MBTL1CYP2C9CYP1A2
SCHEMBL262215 0.81 POLB (0.77) HTTSMN1; SMN2L3MBTL1CYP2C9CYP1A2
SCHEMBL30901879 0.81 POLB (0.77) HTTSMN1; SMN2L3MBTL1CYP2C9CYP1A2
SCHEMBL11742219 0.80 PTGS2 (0.59) HTTCYP2C9TDP1CYP2C19POLB

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-5276001-A Color developer comprising salicylic acid derivative KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1994-01-04 US disclosed