SCHEMBL31034971

SCHEMBL31034971

CCC(CC)(CC)CC(C(N)=O)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
ECE1 P42892 2/20 0.31

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
SCHEMBL12952961 0.81 CA1 (0.32) SLC1A3SLC1A2SLC1A1ECE1
SCHEMBL380595 0.77 SLC1A3 (0.35) SLC1A3SLC1A2SLC1A1ECE1
SCHEMBL12868885 0.76 SLC1A3 (0.34) SLC1A3SLC1A2SLC1A1ECE1
SCHEMBL20629915 0.76 SLC1A3 (0.34) SLC1A3SLC1A2SLC1A1ECE1
SCHEMBL12868893 0.76 SLC1A3 (0.34) SLC1A3SLC1A2SLC1A1ECE1
SCHEMBL12868892 0.76 SLC1A3 (0.34) SLC1A3SLC1A2SLC1A1ECE1
SCHEMBL276565 0.74
SCHEMBL6205731 0.70 CA1 (0.41) SLC1A3SLC1A2SLC1A1ECE1
SCHEMBL1577891 0.70 CA1 (0.41) SLC1A3SLC1A2SLC1A1ECE1
SCHEMBL6204488 0.70 CA1 (0.41) SLC1A3SLC1A2SLC1A1ECE1

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-12153288-B2 Contact lens COOPERVISION INTERNATIONAL LIMITED (GB) 2024-11-26 US disclosed
US-20240264469-A1 CONTACT LENS COOPERVISION INTERNATIONAL LIMITED (GB) 2024-08-08 US disclosed