SCHEMBL9859987

SCHEMBL9859987

C=C(C)C(=O)OCCC([Si](C)(C)O[SiH2]C)([Si](C)(C)O[SiH2]C)[Si](C)(C)O[SiH2]C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.41
TSHR P16473 3/20 0.40
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL6232264 0.86 THRB (0.42) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL991742 0.80 THRB (0.48) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL3920485 0.78 THRB (0.52) THRBTSHRALDH1A1POLBAPEX1
Ethylene SCHEMBL3920482 0.77 THRB (0.50) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL3916830 0.76 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1554939 0.74 THRB (0.43) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL7031855 0.73 TSHR (0.49) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL25332 0.73 THRB (0.42) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL18051644 0.72 THRB (0.52) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL14525085 0.72 TSHR (0.44) THRBTSHRALDH1A1POLBAPEX1

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
US-5011275-A Contact lenses, bandages CIBA-GEIGY CORPORATION (US) 1991-04-30 US disclosed
US-4954587-A CONTACT LENSES CIBA-GEIGY CORPORATION (US) 1990-09-04 US disclosed