SCHEMBL28827697

SCHEMBL28827697

C=C(C)N.CC(C)S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
BLM P54132 3/20 0.32
KDM4E B2RXH2 2/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TSHR P16473 1/20 0.32
NT5E P21589 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
LMNA P02545 1/20 0.32
ALOX15 P16050 1/20 0.32
PMP22 Q01453 1/20 0.32
TP53 P04637 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
SCHEMBL2103162 0.87 TDP1 (0.60) TDP1BLMTSHRLMNAALOX15
SCHEMBL27841407 0.87 TDP1 (0.60) TDP1BLMTSHRLMNAALOX15
SCHEMBL28396465 0.85 TDP1 (0.57) TDP1BLMTSHRLMNAALOX15
Ammonia Solution, Strong SCHEMBL28085557 0.85 TDP1 (0.57) TDP1BLMTSHRLMNAALOX15
Methylamine SCHEMBL5559367 0.81
SCHEMBL5354 0.80
Methacrylic Acid SCHEMBL26931734 0.78 TDP1 (0.35) TDP1TSHRTP53
SCHEMBL7608901 0.77
SCHEMBL7586263 0.77
Fluoride SCHEMBL11339901 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114957325-B Phosphonate compound and application thereof in preparation of filtrate reducer 西南石油大学 2024-03-26 CN claimed
CN-114957325-A Phosphonate compound and application thereof in preparation of fluid loss additive 西南石油大学 2022-08-30 CN claimed
CN-114957325-B Phosphonate compound and application thereof in preparation of filtrate reducer 西南石油大学 2024-03-26 CN disclosed
CN-114957051-A Sulfonic monomer, preparation method and application 西南石油大学 2022-08-30 CN disclosed
CN-114957325-A Phosphonate compound and application thereof in preparation of fluid loss additive 西南石油大学 2022-08-30 CN disclosed