SCHEMBL20126571

SCHEMBL20126571

COC(=O)C(C)CCC(C)(C)C(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
DGAT1 O75907 1/20 0.32
MMP8 P22894 1/20 0.32
ACACB O00763 1/20 0.32
ACACA Q13085 1/20 0.32
CA14 Q9ULX7 2/20 0.31
ZDHHC7 Q9NXF8 1/20 0.31
CA12 O43570 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL10595182 0.85 GABRR1 (0.42) CYP4F2CYP4A11DGAT1ACACBACACA
SCHEMBL20126569 0.82 CA1 (0.30) CA1CA2
SCHEMBL13684875 0.82 CCR2 (0.37) CA1CA2CYP4F2CYP4A11DGAT1
SCHEMBL6199055 0.82 ACACB (0.42) CA1CA2CYP4F2CYP4A11DGAT1
SCHEMBL8222870 0.81 CYP4F2 (0.32) CA1CA2CYP4F2CYP4A11DGAT1
SCHEMBL21704813 0.80 CA1 (0.33) CA1CA2SMN1; SMN2
SCHEMBL18098452 0.80 MMP8 (0.37) CA1CA2SMN1; SMN2USP2LMNA
SCHEMBL10838592 0.80 MMP8 (0.37) CA1CA2SMN1; SMN2USP2LMNA
SCHEMBL23976308 0.78 CA1 (0.37) CA1CA2SMN1; SMN2LMNACA14
SCHEMBL14994678 0.78 GABRP (0.39) CYP4F2CYP4A11DGAT1MMP8ALDH1A1

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-20180127533-A1 One Step Synthesis of Ultrahigh Molecular Weight Block Copolymers CLEMSON UNIVERSITY RESEARCH FOUNDATION 2018-05-10 US disclosed