SCHEMBL28022607

SCHEMBL28022607

CCCCCCCC(I)S(=O)(=O)Oc1ccc(C(C)(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STS P08842 10/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
LMNA P02545 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GRIA4 P48058 1/20 0.38
MMP9 P14780 2/20 0.38
MMP13 P45452 2/20 0.38
ADAM17 P78536 2/20 0.38
MMP1 P03956 1/20 0.38
HDAC3 O15379 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
NR1I2 O75469 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
RECQL P46063 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL28770063 0.76 CA1 (0.51) STSCA1CA2CA9LMNA
Iodide SCHEMBL1516235 0.74 STS (0.50) STSCA1CA2CA9LMNA
Hydrogen Sulfide SCHEMBL15618955 0.74 STS (0.50) STSCA1CA2CA9LMNA
SCHEMBL4957583 0.74 CA1 (0.53) STSCA1CA2CA9LMNA
SCHEMBL575697 0.70 STS (0.38) STSCA1CA2CA9MMP9
SCHEMBL2984771 0.69 CA2 (0.63) STSCA1CA2CA9LMNA
SCHEMBL27816205 0.69 L3MBTL1 (0.38) NR1I2
SCHEMBL28378889 0.68 CA1 (0.43) STSCA1CA2CA9MMP13
SCHEMBL10558497 0.68 CNR2 (0.43) STSCA1CA2CA9LMNA
SCHEMBL23266158 0.68 NR5A1 (0.61) LMNAHSD17B10MAPT

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
CN-104884423-B methanofullerene 亚历克斯·菲利普·格雷厄姆·罗宾逊 2017-11-17 CN disclosed
CN-107087426-A two-step photoresist composition and method 亚历克斯·菲利普·格雷厄姆·罗宾逊 2017-08-22 CN disclosed
CN-104884423-A methanofullerene ROBINSON ALEX PHILIP GRAHAM 2015-09-02 CN disclosed