SCHEMBL207113

SCHEMBL207113

CCC(C)(C)OCC(C)C(C)(P)CC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL208107 0.84 MAPK1 (0.44)
SCHEMBL10260139 0.81 MAPK1 (0.32) ALDH1A1TSHRTDP1
SCHEMBL207550 0.79 MAPK1 (0.31) ALDH1A1TSHRTDP1
SCHEMBL13130836 0.76 ALDH1A1 (0.35) ALDH1A1TSHRTDP1
SCHEMBL21336466 0.74 ALDH1A1 (0.33) ALDH1A1TSHRTDP1
SCHEMBL3297798 0.74 ALDH1A1 (0.41) ALDH1A1TSHRTDP1
SCHEMBL23612631 0.74 ALDH1A1 (0.30) ALDH1A1TSHRTDP1
SCHEMBL26324978 0.72 ALDH1A1 (0.32) ALDH1A1TSHRTDP1
SCHEMBL6446870 0.71 ALDH1A1 (0.35) ALDH1A1TSHRTDP1
SCHEMBL22219400 0.71 ALDH1A1 (0.31) ALDH1A1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120283842-A1 ESOPHAGEAL VALVE DEVICE FOR PLACING IN THE CARDIA VYSERA BIOMEDICAL LIMITED (IE) 2012-11-08 US disclosed
US-20120158026-A1 GASTROINTESTINAL IMPLANT DEVICE VYSERA BIOMEDICAL LIMITED (IE) 2012-06-21 US disclosed
US-20120059486-A1 ESOPHAGEAL VALVE VYSERA BIOMEDICAL LIMITED (IE) 2012-03-08 US disclosed