SCHEMBL28798399

SCHEMBL28798399

COCCOS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
HTR1A P08908 1/20 0.43
HTR2A P28223 1/20 0.43
HTR7 P34969 1/20 0.43
HTR6 P50406 1/20 0.43
ALDH1A1 P00352 4/20 0.43
MAPK1 P28482 2/20 0.43
CYP3A4 P08684 1/20 0.43
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA3 P07451 3/20 0.41
CA4 P22748 3/20 0.41
CA6 P23280 3/20 0.41
CA5A P35218 3/20 0.41
CA7 P43166 3/20 0.41
CA9 Q16790 3/20 0.41
CA13 Q8N1Q1 3/20 0.41
CA14 Q9ULX7 3/20 0.41
CA5B Q9Y2D0 3/20 0.41

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
SCHEMBL27670058 0.83 ALDH1A1 (0.45) HTR2AALDH1A1MAPK1CYP3A4CA12
SCHEMBL85631 0.83 ALDH1A1 (0.50) GAAALDH1A1CYP3A4CA12CA1
SCHEMBL27890927 0.82 ALDH1A1 (0.42) GAAALDH1A1MAPK1CYP3A4CA12
SCHEMBL14258467 0.82 KDM2B (0.43) GAAHTR2AALDH1A1CA12CA1
SCHEMBL11764913 0.82 GAA (0.37) GAAHTR1AHTR2AHTR7HTR6
Water SCHEMBL9985962 0.81 ALDH1A1 (0.49) GAAALDH1A1CYP3A4CA12CA1
SCHEMBL9182366 0.81 PLCG1 (0.44) GAAALDH1A1CA12CA1CA2
SCHEMBL13707919 0.81 MAPK1 (0.46) ALDH1A1MAPK1CYP3A4CA12CA1
SCHEMBL3911054 0.81 MAPK1 (0.50) HTR6ALDH1A1MAPK1CA12CA1
SCHEMBL27649743 0.80 CA2 (0.46) HTR2AALDH1A1MAPK1CYP3A4CA12

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-114835765-B Synthesis process of 2' -O- (2-methoxyethyl) guanosine 奥锐特药业(天津)有限公司 2022-11-08 CN claimed
CN-114835765-A 2 a , Synthesis process of (E) -O- (2-methoxyethyl) guanosine 奥锐特药业(天津)有限公司 2022-08-02 CN claimed
CN-114835765-B Synthesis process of 2' -O- (2-methoxyethyl) guanosine 奥锐特药业(天津)有限公司 2022-11-08 CN disclosed
CN-114835765-A 2 a , Synthesis process of (E) -O- (2-methoxyethyl) guanosine 奥锐特药业(天津)有限公司 2022-08-02 CN disclosed