SCHEMBL524727

SCHEMBL524727

CC(C)OP(=O)(CCOCCCl)OC(C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.33
ACHE P22303 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL6394200 0.82 ALDH1A1 (0.34) CTSAACHEALDH1A1
SCHEMBL525398 0.81 CTSA (0.40) CTSAACHEALDH1A1
SCHEMBL11515008 0.75 CTSA (0.43) CTSAACHEALDH1A1
SCHEMBL525985 0.75 CTSA (0.48) CTSAACHEALDH1A1
SCHEMBL10897020 0.71 CTSA (0.43) CTSAACHEALDH1A1
SCHEMBL11514172 0.71 CTSA (0.43) CTSAACHEALDH1A1
SCHEMBL7739962 0.69 CTSA (0.42) CTSAACHEALDH1A1
SCHEMBL4736507 0.69 CTSA (0.42) CTSAACHEALDH1A1
SCHEMBL11516051 0.69 CTSA (0.42) CTSAACHEALDH1A1
SCHEMBL11514169 0.69 CTSA (0.42) CTSAACHEALDH1A1

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
EP-2598509-B1 METHOD OF THE SYNTHESIS OF DIETHYL OR DIISOPROPYL HALOALKYLPHOSPHONATES AND DIETHYL OR DIISOPROPYL HALOALKYLOXYALKYLPHOSPHONATES ÚSTAV ORGANICKÉ CHEMIE A BIOCHEMIE AKADEMIE VED CESKE REPUBLIKY V V I (CZ) 2018-02-07 EP disclosed
EP-2598509-A1 METHOD OF THE SYNTHESIS OF DIALKYL HALOALKYLPHOSPHONATES AND DIALKYL HALOALKYLOXYALKYLPHOSPHONATES Ustav Organicke Chemie a Biochemie Akademie Ved Ceske Republiky, V.V.I. (CZ) 2013-06-05 EP disclosed
WO-2012013168-A1 METHOD OF THE SYNTHESIS OF DIALKYL HALOALKYLPHOSPHONATES AND DIALKYL HALOALKYLOXYALKYLPHOSPHONATES ÚSTAV ORGANICKÉ CHEMIE A BIOCHEMIE AKADEMIE VĚD ČESKÉ REPUBLIKY, v.v.i. (CZ) 2012-02-02 WO disclosed