SCHEMBL9505966

SCHEMBL9505966

CC(C)C(C(C)C)P(=O)(O)OO

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 1/20 0.36
CTSA P10619 1/20 0.32
ACHE P22303 1/20 0.32
CA2 P00918 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
SCHEMBL10421513 0.77
SCHEMBL11795142 0.74 LAP3 (0.33) LAP3
SCHEMBL7511459 0.74 LAP3 (0.39) LAP3
SCHEMBL774117 0.72 LAP3 (0.36) LAP3CTSAACHECA2
SCHEMBL29018879 0.70 LAP3 (0.35) LAP3CTSAACHE
SCHEMBL8092609 0.70 LAP3 (0.35) LAP3CTSAACHE
Potassium SCHEMBL16650510 0.70 LAP3 (0.35) LAP3CTSAACHE
Water SCHEMBL28618132 0.70 LAP3 (0.35) LAP3CTSAACHE
Calcium SCHEMBL10582435 0.70 LAP3 (0.35) LAP3CTSAACHE
SCHEMBL2589536 0.70 LAP3 (0.35) LAP3CTSAACHE

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
EP-0550574-A1 HETEROCYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1993-07-14 EP disclosed
WO-1992005180-A1 HETEROCYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1992-04-02 WO disclosed