SCHEMBL25867988

SCHEMBL25867988

C=CC(=O)OCCCc1ccc2c(sc3cc(OC(=O)C=C)ccc32)c1OC(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.33
TSHR P16473 2/20 0.32
HPGD P15428 1/20 0.32
ESR1 P03372 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL25853302 0.87 THRB (0.34) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL25853235 0.87 TSHR (0.36) THRBTSHRHPGDESR1ALDH1A1
SCHEMBL25853137 0.86 THRB (0.36) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL25854669 0.86 THRB (0.37) THRBESR1
SCHEMBL25854313 0.85 THRB (0.35) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL25853145 0.84 TSHR (0.37) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL25853308 0.83 POLB (0.35) TSHR
SCHEMBL25853531 0.83 THRB (0.34) THRBTSHRALDH1A1CYP3A4
SCHEMBL25853711 0.82 THRB (0.35) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL25853304 0.81 ESR1 (0.35) THRBESR1ALDH1A1

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-2023134598-A1 POLYMERISABLE COMPOUND, COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed