SCHEMBL26413809

SCHEMBL26413809

CCC(C)(C)OC(=O)C1CO1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 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
SCHEMBL7870788 0.79 MAPK1 (0.38) ALDH1A1
SCHEMBL7870784 0.79 MAPK1 (0.38) ALDH1A1
SCHEMBL20253550 0.78 HPGD (0.33) ALDH1A1TSHR
SCHEMBL5363097 0.75 HRH3 (0.36) ALDH1A1TSHRTDP1
SCHEMBL19822059 0.73 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL15000259 0.73 HRH3 (0.33) ALDH1A1TSHR
SCHEMBL5722404 0.72 ADRB2 (0.41) ALDH1A1TSHRTDP1
SCHEMBL17797272 0.72 TP53 (0.39) ALDH1A1TSHRTDP1
SCHEMBL24129388 0.71 HRH3 (0.36) ALDH1A1TSHRTDP1
SCHEMBL1130166 0.71 ALDH1A1 (0.42) ALDH1A1

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-20230129965-A1 HYDROPHILIC AND OLEOPHOBIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed