SCHEMBL4226440

SCHEMBL4226440

C=C(C)C(O)(CC)C(=CI)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 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
SCHEMBL4845531 0.74 TET2 (0.37) TET2
SCHEMBL4845519 0.74 TET2 (0.37) TET2
SCHEMBL4236652 0.74 TET2 (0.33) TET2
SCHEMBL12159780 0.69 TDP1 (0.38)
SCHEMBL4237934 0.68
SCHEMBL4056674 0.68 HMGCR (0.30)
SCHEMBL4049311 0.67
Methacrylic Acid SCHEMBL9169147 0.65 TET2 (0.39) TET2
Methacrylic Acid SCHEMBL15392404 0.65 TET2 (0.39) TET2
SCHEMBL4629249 0.65 ALDH1A1 (0.45) TET2

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
WO-2009110655-A1 NOVEL BETA SUBSTITUTED MORITA-BAYLIS-HILLMAN DERIVATIVES SUNGKYUNKWAN UNIVERSITY FOUNDATION FOR CORPORATE COLLABORATION (KR) 2009-09-11 WO disclosed