SCHEMBL28066255

SCHEMBL28066255

C=CC(=O)OP(=O)(O)O.[AlH3]

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.42
CA4 P22748 1/20 0.42
TSHR P16473 7/20 0.36
ALDH1A1 P00352 6/20 0.36
TP53 P04637 3/20 0.36
HIF1A Q16665 3/20 0.36
CYP3A4 P08684 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
FDPS P14324 1/20 0.32
BLM P54132 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.32
FGFR4 P22455 1/20 0.30
LPAR2 Q9HBW0 1/20 0.30
LPAR3 Q9UBY5 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
SCHEMBL56637 0.97
SCHEMBL2301184 0.95 PEPD (0.42) PEPDCA4TSHRALDH1A1TP53
Water SCHEMBL22418780 0.95 PEPD (0.42) PEPDCA4TSHRALDH1A1TP53
SCHEMBL28217374 0.95 PEPD (0.42) PEPDCA4TSHRALDH1A1TP53
SCHEMBL14856573 0.90 PEPD (0.39) PEPDCA4TSHRALDH1A1TP53
SCHEMBL1885795 0.86 PEPD (0.37) PEPDCA4TSHRALDH1A1TP53
Maleic Acid SCHEMBL6232606 0.86 PEPD (0.41) PEPDCA4TSHRALDH1A1TP53
Acrylonitrile SCHEMBL28109493 0.84 TSHR (0.38) PEPDCA4TSHRALDH1A1TP53
SCHEMBL8495295 0.81 TSHR (0.37) PEPDCA4TSHRALDH1A1TP53
SCHEMBL28304950 0.81 TDP1 (0.46) PEPDCA4TSHRALDH1A1TDP1

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-105860609-A High-temperature-resistant anti-corrosion ceramic coating and preparation method thereof 黄河科技学院 2016-08-17 CN disclosed
CN-105802287-A Environment-friendly high-temperature-resistant paint and preparation method thereof 黄河科技学院 2016-07-27 CN disclosed
CN-105694553-A High-temperature-resistant paint and preparation method thereof 黄河科技学院 2016-06-22 CN disclosed