SCHEMBL28129182

SCHEMBL28129182

C=CS(=O)(=O)Oc1cccc2ccccc12.[RbH]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 3/20 0.40
HPGD P15428 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
HSD17B10 Q99714 3/20 0.39
PGR P06401 1/20 0.39
GAA P10253 1/20 0.39
PTGS1 P23219 1/20 0.39
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.39
HTR1B P28222 4/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
RAB9A P51151 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
KCNA3 P22001 1/20 0.37
OGG1 O15527 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
SCHEMBL6718010 0.98 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL28129713 0.97 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL28129678 0.91 HPRT1 (0.42) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL28129719 0.89 HPRT1 (0.44) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL28129714 0.87 HPRT1 (0.42) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL28129706 0.85 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL8752166 0.83 ALDH1A1 (0.37) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL311749 0.82 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL28129174 0.82 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL1253062 0.81 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDTDP1HSD17B10

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-106459653-B Hydrophily monofilm 三井化学株式会社 2019-03-01 CN disclosed
CN-105814092-B Composition for hydrophilic cured product 三井化学株式会社 2018-09-21 CN disclosed
CN-106459653-A Hydrophilic single-layer film 三井化学株式会社 2017-02-22 CN disclosed