SCHEMBL26412852

SCHEMBL26412852

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

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SOAT1 P35610 1/20 0.36
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
DGAT1 O75907 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
SCHEMBL47990 0.91 SOAT1 (0.42) ALDH1A1TSHRTDP1SOAT1
SCHEMBL2231156 0.89 TSHR (0.43) ALDH1A1TSHRTDP1CA1CA2
SCHEMBL13942557 0.84 SOAT1 (0.37) ALDH1A1TSHRTDP1SOAT1CA1
SCHEMBL475144 0.81 TSHR (0.43) ALDH1A1TSHRTDP1SOAT1
SCHEMBL19821822 0.80 ALDH1A1 (0.39) ALDH1A1TSHRTDP1SOAT1
SCHEMBL3793443 0.80 ALDH1A1 (0.35) ALDH1A1TSHRTDP1SOAT1
SCHEMBL16738135 0.77 ALDH1A1 (0.39) ALDH1A1TSHRTDP1SOAT1
SCHEMBL9638438 0.77 DGAT1 (0.46) ALDH1A1TDP1SOAT1CA1CA2
SCHEMBL27338198 0.76 TSHR (0.40) ALDH1A1TSHRTDP1CA1CA2
SCHEMBL5136985 0.76 TSHR (0.35) 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 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