SCHEMBL28287196

SCHEMBL28287196

CC(C)ONP(=O)(O)OC(C)C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CTSA P10619 1/20 0.39
ACHE P22303 1/20 0.39
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
CA9 Q16790 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
SCHEMBL17346874 0.75
SCHEMBL11882370 0.73
SCHEMBL20078943 0.73 KDM4E (0.44) KDM4ETDP1CTSAACHEALDH1A1
SCHEMBL4272700 0.70
SCHEMBL23979197 0.70 KDM4E (0.42) KDM4ETDP1CTSAACHEALDH1A1
SCHEMBL21764562 0.70 KDM4E (0.55) KDM4ETDP1CTSAACHECA12
SCHEMBL9570172 0.69
SCHEMBL24508556 0.68 KDM4E (0.41) KDM4ETDP1CTSAACHEALDH1A1
SCHEMBL268599 0.68 CTSA (0.50) KDM4ETDP1CTSAACHEALDH1A1
Phosphorylisopropane SCHEMBL82996 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109485560-A A kind of method of selectivity synthesis hexafluoropropylene oxide oligomer 湖南有色郴州氟化学有限公司 2019-03-19 CN claimed
CN-109485560-A A kind of method of selectivity synthesis hexafluoropropylene oxide oligomer 湖南有色郴州氟化学有限公司 2019-03-19 CN disclosed