SCHEMBL28075752

SCHEMBL28075752

O=S(=O)(O)OCn1ccnc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
EGLN3 Q9H6Z9 1/20 0.43
TBXAS1 P24557 4/20 0.41
FDPS P14324 4/20 0.41
GGPS1 O95749 3/20 0.39
BTN3A1 O00481 1/20 0.39
CA12 O43570 1/20 0.39
CA2 P00918 1/20 0.39
LMNA P02545 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP14 P50281 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39

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
SCHEMBL27538763 0.81 EGLN3 (0.49) ALDH1A1EGLN3TBXAS1LMNA
SCHEMBL466166 0.79 ALDH1A1 (0.41) ALDH1A1EGLN3TBXAS1FDPSLMNA
SCHEMBL19975463 0.78 ALDH1A1 (0.39) ALDH1A1EGLN3TBXAS1
Sulfuric Acid SCHEMBL28167966 0.77 ALDH1A1 (0.42) ALDH1A1EGLN3TBXAS1FDPSLMNA
SCHEMBL21332122 0.77 ALDH1A1 (0.40) ALDH1A1EGLN3TBXAS1LMNA
SCHEMBL1582316 0.76 TBXAS1 (0.47) ALDH1A1EGLN3TBXAS1FDPSLMNA
SCHEMBL22832290 0.74 ALDH1A1 (0.43) ALDH1A1EGLN3TBXAS1FDPS
SCHEMBL22832302 0.74 TBXAS1 (0.57) ALDH1A1TBXAS1LMNA
SCHEMBL169300 0.74 LMNA (0.44) ALDH1A1EGLN3TBXAS1FDPSLMNA
SCHEMBL27960933 0.74 ALDH1A1 (0.50) ALDH1A1EGLN3TBXAS1FDPSGGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102947551-B Method and apparatus for operating a steam cycle process with lubricated expander 曼卡车和巴士股份公司 2016-07-06 CN claimed
CN-106687580-A Stabilization of metabolically-active cells in a blood sample at ambient temperatures 生物马特里卡公司 2017-05-17 CN disclosed