SCHEMBL28358348

SCHEMBL28358348

CCOP(=O)(CC=C(C)C(=O)O)OCC

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
PPARD Q03181 2/20 0.41
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NR1I2 O75469 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
PGGT1B P53609 1/20 0.31

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
SCHEMBL8734587 1.00 TSHR (0.41) TSHRPPARDMAPTMAPK1TP53
SCHEMBL9653714 0.81 GLO1 (0.40) TSHRPPARDMAPTMAPK1
SCHEMBL5873561 0.81 GLO1 (0.40) TSHRPPARDMAPTMAPK1
SCHEMBL28361944 0.81 TSHR (0.39) TSHRPPARDMAPTMAPK1TP53
SCHEMBL8576108 0.81 GLO1 (0.40) TSHRPPARDMAPTMAPK1
SCHEMBL8165454 0.80 FNTA (0.32) FNTAFNTB
SCHEMBL9491442 0.80 FNTA (0.32) FNTAFNTB
SCHEMBL2458072 0.79 TSHR (0.48) TSHRPPARDMAPTTP53TDP1
SCHEMBL9617956 0.79 GABRR1 (0.41) TSHRPPARDMAPTMAPK1TP53
SCHEMBL10333808 0.79 GABRR1 (0.41) TSHRPPARDMAPTMAPK1TP53

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-118271362-A Preparation method of C5 phosphonate 万华化学集团股份有限公司 2024-07-02 CN disclosed
CN-110655533-B Preparation method of 4- (diethoxy-phosphoryl) -2-methyl-butyl-2-olefine acid ester 上虞新和成生物化工有限公司 2022-05-06 CN disclosed
CN-110655533-A Preparation method of 4- (diethoxy-phosphoryl) -2-methyl-butyl-2-olefine acid ester 上虞新和成生物化工有限公司 2020-01-07 CN disclosed