SCHEMBL28686249

SCHEMBL28686249

NCCNC(C(=O)O)C(C(=O)O)(C(=O)O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GGT1 P19440 1/20 0.42
GABRR1 P24046 2/20 0.35
CPB2 Q96IY4 7/20 0.34
CPB1 P15086 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
SCHEMBL3749598 0.79 GGT1 (0.42) GGT1GABRR1CPB2CPB1
SCHEMBL8038154 0.76 GGT1 (0.37) GGT1GABRR1
SCHEMBL2434944 0.73 GGT1 (0.38) GGT1GABRR1CPB2CPB1
SCHEMBL9450993 0.71 GGT1 (0.36) GGT1GABRR1CPB2CPB1
SCHEMBL525469 0.70 GGT1 (0.48) GGT1GABRR1CPB2CPB1
SCHEMBL28710177 0.69 GGT1 (0.33) GGT1GABRR1
SCHEMBL29797936 0.69 GGT1 (0.47) GGT1GABRR1CPB2CPB1
SCHEMBL2153086 0.69 GGT1 (0.47) GGT1GABRR1CPB2CPB1
SCHEMBL29797573 0.69 GGT1 (0.47) GGT1GABRR1CPB2CPB1
SCHEMBL28085930 0.69 GGT1 (0.47) GGT1GABRR1CPB2CPB1

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
CN-109576688-B Chemical nickel plating solution containing soapnut saponin hydrolysate, nickel plating method and nickel plated part 浙江外国语学院 2022-02-11 CN claimed
CN-109576688-B Chemical nickel plating solution containing soapnut saponin hydrolysate, nickel plating method and nickel plated part 浙江外国语学院 2022-02-11 CN disclosed