SCHEMBL23943455

SCHEMBL23943455

C=C(C)C(=O)OCCNC(=O)NNC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
TSHR P16473 3/20 0.43
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL23943673 0.92 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL23943892 0.88 THRB (0.47) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL23943679 0.88 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL2195083 0.87 THRB (0.52) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL23943743 0.87 THRB (0.42) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL23943901 0.87 THRB (0.42) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL23943854 0.84 THRB (0.40) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL22657385 0.84 THRB (0.40) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL685408 0.83 THRB (0.52) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL10093531 0.83 THRB (0.49) THRBTSHRALDH1A1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203221-A1 MONOMERS, POLYMERS, AND ARTICLES FOR BIOMATERIAL CAPTURE SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2023-06-29 US disclosed
US-20230203221-A1 MONOMERS, POLYMERS, AND ARTICLES FOR BIOMATERIAL CAPTURE SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2023-06-29 US disclosed
WO-2021209859-A1 MONOMERS, POLYMERS, AND ARTICLES FOR BIOMATERIAL CAPTURE 3M INNOVATIVE PROPERTIES COMPANY (US) 2021-10-21 WO disclosed