SCHEMBL28082607

SCHEMBL28082607

CCC(=O)OCS(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.41
ALDH1A1 P00352 6/20 0.38
CYP1A2 P05177 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
BLM P54132 1/20 0.38
WRN Q14191 1/20 0.38
HIF1A Q16665 1/20 0.38
GAA P10253 2/20 0.35
MGAM O43451 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
SOAT1 P35610 1/20 0.35
TRPA1 O75762 1/20 0.32
HTT P42858 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 2/20 0.30
FFAR3 O14843 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL28082642 0.98 NAAA (0.40) NAAAALDH1A1CYP1A2HPGDCYP2C19
Ammonia Solution, Strong SCHEMBL28082724 0.98 NAAA (0.40) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL28082443 0.98 NAAA (0.40) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL28082567 0.98 NAAA (0.40) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL28082531 0.98 NAAA (0.40) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL28082406 0.98 NAAA (0.40) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL27385840 0.81 ALDH1A1 (0.48) ALDH1A1CYP1A2LMNATDP1FFAR3
SCHEMBL11208718 0.80 NAAA (0.41) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL28189955 0.79 ALDH1A1 (0.46) ALDH1A1CYP1A2LMNATDP1FFAR3
SCHEMBL28189990 0.79 ALDH1A1 (0.46) ALDH1A1CYP1A2LMNAFFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105814092-B Composition for hydrophilic cured product 三井化学株式会社 2018-09-21 CN disclosed
CN-107430213-A Hydrophilic optical feature monofilm and its layered product 三井化学株式会社 2017-12-01 CN disclosed
CN-106458998-A Pyrazine derivative 帝人制药株式会社 2017-02-22 CN disclosed
CN-105814092-A Composition for hydrophilic cured product 三井化学株式会社 2016-07-27 CN disclosed