SCHEMBL31469845

SCHEMBL31469845

C=C(C)C(=O)OCCC(O)CC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.47
▸ TSHR P16473 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.37
▸ TDP1 Q9NUW8 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL36359 0.83 THRB (0.48) THRBTSHRALDH1A1TDP1POLB
SCHEMBL3680977 0.83 TSHR (0.57) THRBTSHRALDH1A1TDP1POLB
SCHEMBL1132926 0.83 THRB (0.53) THRBTSHRALDH1A1TDP1POLB
SCHEMBL27606247 0.81 THRB (0.47) THRBTSHRALDH1A1TDP1POLB
SCHEMBL1132960 0.81 TSHR (0.55) THRBTSHRALDH1A1TDP1POLB
SCHEMBL27830140 0.81 THRB (0.47) THRBTSHRALDH1A1TDP1POLB
SCHEMBL665302 0.80 THRB (0.53) THRBTSHRALDH1A1TDP1POLB
SCHEMBL8907667 0.80 ALOX15 (0.43) TSHRALDH1A1TDP1
SCHEMBL6675365 0.80 TSHR (0.53) THRBTSHRALDH1A1TDP1POLB
SCHEMBL9243433 0.79 TSHR (0.61) THRBTSHRALDH1A1TDP1POLB

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-2025026727-A1 POLYMER COMPOSITION AND METHODS OF MAKING AND USING THEREOF SPECIALTY OPERATIONS FRANCE (FR) 2025-02-06 — — WO disclosed
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