SCHEMBL6894736

SCHEMBL6894736

C=C(C)C(=O)OCCCC[Si](C)(C)O[SiH](C)C

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.51
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
THRB P10828 1/20 0.41
ALDH1A1 P00352 2/20 0.36

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
SCHEMBL7586895 0.95 TSHR (0.49) TSHRPOLBAPEX1HTTTDP1
SCHEMBL15497553 0.86 TSHR (0.49) TSHRPOLBAPEX1HTTTDP1
SCHEMBL20726541 0.85 TSHR (0.49) TSHRPOLBAPEX1HTTTDP1
SCHEMBL12313569 0.84 TSHR (0.42) TSHRPOLBAPEX1HTTTDP1
SCHEMBL3622054 0.83 TSHR (0.58) TSHRPOLBAPEX1HTTTDP1
SCHEMBL11986800 0.83 TSHR (0.44) TSHRPOLBAPEX1HTTTDP1
SCHEMBL6652511 0.83 TSHR (0.49) TSHRPOLBAPEX1HTTTDP1
SCHEMBL15355902 0.82 TSHR (0.61) TSHRPOLBAPEX1HTTTDP1
SCHEMBL15355910 0.82 TSHR (0.56) TSHRPOLBAPEX1HTTTDP1
SCHEMBL15355891 0.82 TSHR (0.56) TSHRPOLBAPEX1HTTTDP1

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-6730767-B2 OPTICAL TRANSPARENT; BIOCOMPATIBLE MEDICAL EQUIPMENT BAUSCH & LOMB INCORPORATED 2004-05-04 US disclosed