SCHEMBL28358933

SCHEMBL28358933

C[Se]CCC(N)C(O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.38
ALDH1A1 P00352 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
METAP1 P53582 1/20 0.31
LAP3 P28838 1/20 0.30
LMNA P02545 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
SCHEMBL28358931 0.80 FDPS (0.41) FDPSLAP3LMNA
SCHEMBL6665925 0.78 FDPS (0.50) FDPSMETAP1LAP3
SCHEMBL5262879 0.74 FDPS (0.61) FDPSLAP3
SCHEMBL5489929 0.73 LAP3 (0.46) FDPSMETAP1LAP3LMNA
SCHEMBL6132043 0.73 LAP3 (0.46) FDPSMETAP1LAP3LMNA
SCHEMBL28355348 0.72 FDPS (0.41) FDPSMETAP1LAP3
SCHEMBL8591903 0.72 FDPS (0.68) FDPSLAP3
SCHEMBL5054803 0.70 FDPS (0.41) FDPSLAP3LMNA
SCHEMBL5054818 0.70 ANPEP (0.44) FDPSLAP3LMNA
SCHEMBL3936724 0.65 FDPS (0.50) FDPSALDH1A1TDP1METAP1LAP3

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-106083925-B Diphosphonic acid compound and preparation method and application thereof 成都云克药业有限责任公司 2019-12-31 CN disclosed