SCHEMBL8525895

SCHEMBL8525895

C=C(C(=O)O)C(COCC)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.34
TET2 Q6N021 3/20 0.30
TET3 O43151 1/20 0.30
TET1 Q8NFU7 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 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
SCHEMBL7081650 0.82 ALDH1A1 (0.37) THRBALDH1A1TSHR
SCHEMBL28761792 0.76 THRB (0.32) THRB
SCHEMBL11390212 0.76 ALDH1A1 (0.38) THRBALDH1A1TSHR
SCHEMBL168334 0.75 TET2 (0.36) TET2TET3TET1
SCHEMBL1794769 0.71 CHRM1 (0.48) TET2TSHR
SCHEMBL165640 0.71 ALDH1A1 (0.48) THRBALDH1A1TSHR
Methacrylic Acid SCHEMBL28569360 0.71 THRB (0.42) THRBTET2TET3TET1ALDH1A1
SCHEMBL7055705 0.71 THRB (0.33) THRB
SCHEMBL351355 0.70 ALDH1A1 (0.46) THRBALDH1A1TSHR
SCHEMBL15866578 0.69

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
EP-0795182-B1 ION-CONDUCTIVE POLYMERS DANACELL APS (DK) 1999-03-03 EP disclosed