SCHEMBL7127653

SCHEMBL7127653

C=C(C)C(=O)OCCC[Si](C)(C)O[Si](C)(C)C.C=C(C)C(=O)OCCC[Si](C)(OC)OC

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
THRB P10828 1/20 0.39
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 2/20 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
SCHEMBL35511 0.92 TSHR (0.51) TSHRTHRBPOLBAPEX1HTT
SCHEMBL13334671 0.91 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16642157 0.90 TSHR (0.46) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12373217 0.90 TSHR (0.46) TSHRTHRBPOLBAPEX1HTT
SCHEMBL5600819 0.89 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12373191 0.89 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12759258 0.89 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12759262 0.89 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12759260 0.89 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL12759322 0.89 TSHR (0.49) 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
US-20030027892-A1 Ink jet ink composition EASTMAN KODAK COMPANY 2003-02-06 US disclosed