SCHEMBL8842576

SCHEMBL8842576

COC(=O)C(CCCCC(C)(C)C)O[SiH](C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ZDHHC7 Q9NXF8 1/20 0.33
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL8842692 0.97 CA1 (0.37) CA1CA2ZDHHC7SMN1; SMN2
SCHEMBL9734360 0.83 ACACB (0.36) ACACBACACA
SCHEMBL4844795 0.82 ACACB (0.39) ACACBACACA
SCHEMBL7562343 0.82 ACACB (0.39) ACACBACACA
SCHEMBL9733603 0.81
SCHEMBL17523790 0.75 CA1 (0.41) CA1CA2ZDHHC7ACACBACACA
SCHEMBL17523840 0.74 ZDHHC7 (0.42) CA1CA2ZDHHC7ACACBACACA
SCHEMBL28405498 0.74 CA1 (0.40) CA1CA2ZDHHC7ACACBACACA
SCHEMBL17523916 0.74 ZDHHC7 (0.42) CA1CA2ZDHHC7ACACBACACA
SCHEMBL6178484 0.72 ACACB (0.32) ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5683994-A BONE DISORDERS BOEHRINGER MANNHEIM GMBH (DE) 1997-11-04 US disclosed