Adamantane

Adamantane

SCHEMBL8214531

C1C2CC3CC1CC(C2)C3.C=COC(=O)OC

nearest known ligand 0.34

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.34
CHRNA4 P43681 2/20 0.34
EPHX2 P34913 1/20 0.32
GLA P06280 1/20 0.32
HSD11B1 P28845 1/20 0.30

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
SCHEMBL165020 0.86
Water SCHEMBL29110910 0.84
Bicarbonate SCHEMBL26644658 0.81 HCAR2 (0.33)
Bicarbonate SCHEMBL22343889 0.81 HCAR2 (0.33)
Acetic Acid SCHEMBL28131600 0.79 ALDH1A1 (0.36)
SCHEMBL19923838 0.79 KEAP1 (0.35)
Adamantane SCHEMBL8215319 0.78 ALDH1A1 (0.44) HSD11B1
Acrylic Acid SCHEMBL29180775 0.77 LMNA (0.48)
Adamantane SCHEMBL8214614 0.75 TSHR (0.37) HSD11B1
Adamantane SCHEMBL28199672 0.73 HCAR2 (0.42) CHRNB2CHRNA4GLA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6166236-A Vinyl carbonate and vinyl carbamate contact lens material monomers BAUSCH & LOMB INCORPORATED (US) 2000-12-26 US claimed
EP-0396364-B1 Copolymers of vinyl carbonate and vinyl carbamate as contact lens material BAUSCH & LOMB (US) 1997-06-11 EP claimed
US-5610252-A Vinyl carbonate and vinyl carbamate contact lens material monomers BAUSCH & LOMB INCORPORATED (US) 1997-03-11 US claimed
EP-0396364-A2 Novel vinyl carbonate and vinyl carbamate contact lens material monomers BAUSCH & LOMB INCORPORATED (US) 1990-11-07 EP claimed