SCHEMBL28908151

SCHEMBL28908151

COC(=O)NC(CCCl)C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 4/20 0.35
TAS1R1 Q7RTX1 4/20 0.35
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
CYP2C9 P11712 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
GAA P10253 1/20 0.33
FOLH1 Q04609 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
KYNU Q16719 1/20 0.32
HTT P42858 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
SCHEMBL28908150 1.00 TAS1R3 (0.35) TAS1R3TAS1R1ALDH1A1L3MBTL1CYP2C9
SCHEMBL9188092 0.87 L3MBTL1 (0.47) ALDH1A1L3MBTL1CYP2C9GAASMN1; SMN2
SCHEMBL28981488 0.87 L3MBTL1 (0.47) ALDH1A1L3MBTL1CYP2C9GAASMN1; SMN2
SCHEMBL11426369 0.87 TAS1R3 (0.37) TAS1R3TAS1R1ALDH1A1CA1CA2
Hydrochloric Acid SCHEMBL29184128 0.85 L3MBTL1 (0.46) ALDH1A1L3MBTL1CYP2C9GAASMN1; SMN2
Hydrochloric Acid SCHEMBL29184127 0.85 L3MBTL1 (0.46) ALDH1A1L3MBTL1CYP2C9GAASMN1; SMN2
SCHEMBL9152871 0.84 FOLH1 (0.41) ALDH1A1FOLH1SMN1; SMN2
SCHEMBL9152878 0.84 FOLH1 (0.41) ALDH1A1FOLH1SMN1; SMN2
SCHEMBL22207692 0.84 KDM4E (0.39) TAS1R3TAS1R1ALDH1A1L3MBTL1CYP2C9
SCHEMBL11441433 0.78 CA1 (0.53) TAS1R3TAS1R1CA1CA2

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
CN-115448950-A Preparation method of L-glufosinate-ammonium intermediate 中国药科大学 2022-12-09 CN disclosed