SCHEMBL27361285

SCHEMBL27361285

C=C(C)C(=O)OCCC[Si](C)(C)O[Si](C)(C)CCC(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
THRB P10828 1/20 0.38
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL27428980 0.93 TSHR (0.41) TSHRTHRBPOLBAPEX1HTT
SCHEMBL2404652 0.92 TSHR (0.42) TSHRTHRBPOLBAPEX1HTT
SCHEMBL13334705 0.88 TSHR (0.39) TSHRTHRBPOLBAPEX1HTT
SCHEMBL64810 0.88 TSHR (0.55) TSHRTHRBPOLBAPEX1HTT
SCHEMBL26561519 0.86 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL10329836 0.86 TSHR (0.47) TSHRTHRBPOLBAPEX1HTT
SCHEMBL14130481 0.85 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL10329839 0.84 TSHR (0.45) TSHRTHRBPOLBAPEX1HTT
SCHEMBL17718723 0.83 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL17059112 0.83 TSHR (0.50) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1070494-C Monomeric units useful for reducing modulus of low water polymeric silicone composition BAUSCH & LOMB (US) 2001-09-05 CN disclosed
CN-1204338-A Monomers for reducing modulus of low water polysiloxane compositions BAUSCH & LOMB (US) 1999-01-06 CN disclosed