SCHEMBL31440657

SCHEMBL31440657

C=C(C)C(=O)OCCCCCCCCCCCC[Si](OCCC)(OCCC)OCCC

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.65
THRB P10828 1/20 0.45
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ACHE P22303 9/20 0.37
NAAA Q02083 1/20 0.36
ALDH1A1 P00352 1/20 0.35
RAD52 P43351 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
EPHX1 P07099 1/20 0.34

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
SCHEMBL28327694 1.00 TSHR (0.65) TSHRTHRBPOLBAPEX1HTT
SCHEMBL22115855 1.00 TSHR (0.65) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11740820 0.98 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL72841 0.94 TSHR (0.59) TSHRTHRBPOLBAPEX1HTT
SCHEMBL3504198 0.93 TSHR (0.59) TSHRTHRBPOLBAPEX1HTT
SCHEMBL18037128 0.92 TSHR (0.73) TSHRTHRBPOLBAPEX1HTT
SCHEMBL22115828 0.92 TSHR (0.68) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11740476 0.91 TSHR (0.65) TSHRTHRBPOLBAPEX1HTT
SCHEMBL6570695 0.89 TSHR (0.73) TSHRTHRBPOLBAPEX1HTT
SCHEMBL10665304 0.89 TSHR (0.73) TSHRTHRBPOLBAPEX1HTT

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-4545060-A1 COMPOSITION FOR THREE-DIMENSIONAL MODELING AND METHOD FOR PRODUCING DENTAL MODELED OBJECT GC Corporation (JP) 2025-04-30 EP disclosed