SCHEMBL28697332

SCHEMBL28697332

CCOOC(=O)OC(C)O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32

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
SCHEMBL3635293 0.80 TSHR (0.37) ALDH1A1SOAT1
SCHEMBL919515 0.77 ALDH1A1 (0.47) ALDH1A1MGAMGAASIMGAM2
SCHEMBL1111518 0.76
SCHEMBL8747973 0.75 ALDH1A1 (0.45) ALDH1A1MGAMGAASIMGAM2
SCHEMBL8187695 0.74 TSHR (0.40) ALDH1A1
SCHEMBL11451596 0.72 SOAT1 (0.52) ALDH1A1MGAMGAASIMGAM2
Isopropyl Alcohol SCHEMBL3252052 0.71 ALDH1A1 (0.42) ALDH1A1SOAT1
SCHEMBL809407 0.70
SCHEMBL28210402 0.70 GPR84 (0.37) ALDH1A1
SCHEMBL2486996 0.69

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
CN-113999598-A Preparation method of bi-component water-based paint 李亚静 2022-02-01 CN disclosed
CN-113913095-A Environment-friendly antibacterial coating and preparation method thereof 李亚静 2022-01-11 CN disclosed
CN-113845826-A Two-component water-based paint 李亚静 2021-12-28 CN disclosed