SCHEMBL24809377

SCHEMBL24809377

C=CC(=O)OCCC(=O)Sc1ccc(C#Cc2ccc(-c3ccc(C#Cc4ccc(SC(=O)CCOC(=O)C=C)cc4)cc3C)c(C)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.35
MAPT P10636 5/20 0.35
THRB P10828 1/20 0.35
TSHR P16473 5/20 0.34
ALDH1A1 P00352 4/20 0.33
CYP3A4 P08684 1/20 0.33
HSD17B10 Q99714 2/20 0.32
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
PPARD Q03181 1/20 0.30
PPARA Q07869 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
SCHEMBL24806608 0.85 THRB (0.37) HPGDMAPTTHRBTSHRALDH1A1
SCHEMBL24809371 0.84 TSHR (0.39) HPGDTHRBTSHRALDH1A1CYP3A4
SCHEMBL24806605 0.81 THRB (0.47) HPGDTHRBTSHRALDH1A1CYP3A4
SCHEMBL24806600 0.81 THRB (0.47) HPGDMAPTTHRBTSHRALDH1A1
SCHEMBL24806610 0.81 THRB (0.40) HPGDMAPTTHRBTSHRALDH1A1
SCHEMBL24808445 0.81 THRB (0.34) HPGDTHRBTSHRPPARDPPARA
SCHEMBL24806602 0.80 THRB (0.55) HPGDMAPTTHRBTSHRALDH1A1
SCHEMBL24806603 0.80 THRB (0.42) THRBTSHRALDH1A1HSD17B10TP53
SCHEMBL24806719 0.80 THRB (0.33) MAPTTHRBPPARDPPARA
SCHEMBL24809370 0.79 TSHR (0.39) HPGDMAPTTHRBTSHRALDH1A1

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-2022270562-A1 COMPOUND, COMPOSITION, CURED PRODUCT, OPTICALLY ANISOTROPIC BODY, OPTICAL ELEMENT, AND LIGHT GUIDE ELEMENT 富士フイルム株式会社 2022-12-29 WO disclosed