SCHEMBL26655448

SCHEMBL26655448

CC(=O)OOP(=O)(O)O.[NaH]

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
FDPS P14324 1/20 0.33
BLM P54132 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA4 P22748 1/20 0.32
CA2 P00918 1/20 0.30

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
SCHEMBL1548799 0.97
SCHEMBL27547176 0.80 ALDH1A1 (0.35) ALDH1A1TSHRCA2
SCHEMBL11506009 0.78
SCHEMBL9321662 0.77 ALDH1A1 (0.37) ALDH1A1TSHRTDP1
SCHEMBL5312856 0.76 FDPS (0.32) TSHRFDPSBLMTDP1CA4
SCHEMBL11506004 0.74 ALDH1A1 (0.50) ALDH1A1TSHRTDP1CA2
SCHEMBL26655445 0.72 LMNA (0.36) ALDH1A1TSHRCA4
SCHEMBL908616 0.72 ALDH1A1 (0.44) ALDH1A1TSHRTDP1
SCHEMBL9199747 0.71 FDPS (0.50) FDPSBLMTDP1CA4CA2
SCHEMBL9016987 0.71 FDPS (0.50) FDPSBLMTDP1CA4CA2

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
WO-2023216719-A1 ALKYL PHOSPHINATE COMPOSITION, AND PREPARATION METHOD THEREFOR AND USE THEREOF 江苏利思德新材料股份有限公司 2023-11-16 WO disclosed