SCHEMBL28622104

SCHEMBL28622104

O=S(=O)(c1ccccc1)c1cc(OCCO)ccc1S

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
RECQL P46063 1/20 0.45
MMP2 P08253 4/20 0.44
MMP12 P39900 3/20 0.44
MMP13 P45452 3/20 0.44
MMP14 P50281 3/20 0.44
MMP1 P03956 2/20 0.44
MMP3 P08254 2/20 0.44
MMP9 P14780 2/20 0.44
GAA P10253 2/20 0.43
HTR6 P50406 2/20 0.40
F2 P00734 2/20 0.38
POLB P06746 2/20 0.38
GFER P55789 1/20 0.38
CA1 P00915 2/20 0.37
MMP8 P22894 2/20 0.37
MMP16 P51512 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37

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
SCHEMBL28622102 0.82 SLC6A2 (0.44) ALDH1A1RECQLMMP2MMP12MMP13
SCHEMBL4354588 0.72 MMP2 (0.53) ALDH1A1RECQLMMP2MMP12MMP13
SCHEMBL2315856 0.72 ALDH1A1 (0.52) ALDH1A1RECQLGAAHTR6F2
SCHEMBL778999 0.72 ALDH1A1 (0.45) ALDH1A1RECQLMMP2MMP12MMP13
SCHEMBL2637714 0.71 ALDH1A1 (0.58) ALDH1A1RECQLMMP2MMP12MMP13
SCHEMBL34118 0.71 ALDH1A1 (0.58) ALDH1A1RECQLMMP2MMP12MMP13
Ethylene Glycol SCHEMBL8592846 0.70 ALDH1A1 (0.56) ALDH1A1RECQLMMP2MMP12MMP13
SCHEMBL811463 0.69 ALDH1A1 (0.55) ALDH1A1RECQLMMP2MMP12MMP13
SCHEMBL811899 0.69 ALDH1A1 (0.55) ALDH1A1RECQLMMP2MMP12MMP13
SCHEMBL10181500 0.69 MMP2 (0.49) ALDH1A1MMP2MMP12MMP13MMP14

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-114286832-A Photocurable resin composition for electronic device 积水化学工业株式会社 2022-04-05 CN disclosed
CN-113811558-A Photocurable resin composition for electronic device 积水化学工业株式会社 2021-12-17 CN disclosed
CN-113195661-A Adhesive composition, adhesive for electronic component, and adhesive for display element 积水化学工业株式会社 2021-07-30 CN disclosed