SCHEMBL28934741

SCHEMBL28934741

CCCC(Cl)OP(=O)(O)OC(Cl)CCC

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.44
METAP1 P53582 2/20 0.42
SMPD1 P17405 3/20 0.39
S1PR2 O95136 5/20 0.33
S1PR1 P21453 5/20 0.33
S1PR3 Q99500 5/20 0.33
S1PR4 O95977 4/20 0.33
LAP3 P28838 2/20 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
SCHEMBL9499300 0.86 SMPD1 (0.48) FDPSMETAP1SMPD1S1PR2S1PR1
SCHEMBL10536255 0.81 FDPS (0.37) FDPSMETAP1SMPD1
SCHEMBL3689352 0.81 LAP3 (0.37) FDPSMETAP1SMPD1LAP3
SCHEMBL2780660 0.79
SCHEMBL5497897 0.77 METAP1 (0.38) FDPSMETAP1SMPD1
SCHEMBL15263431 0.77 METAP1 (0.42) FDPSMETAP1SMPD1S1PR2S1PR1
SCHEMBL27727331 0.77 FDPS (0.42) FDPSSMPD1S1PR2S1PR1S1PR3
SCHEMBL3824536 0.76 FDPS (0.48) FDPSMETAP1SMPD1S1PR2S1PR1
SCHEMBL27848688 0.75 FDPS (0.30) FDPS
SCHEMBL2471725 0.74 METAP1 (0.48) FDPSMETAP1SMPD1S1PR2S1PR1

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-115433376-A Preparation method of long-acting disinfection and sterilization fabric or fiber 孙国明 2022-12-06 CN claimed
CN-115433376-A Preparation method of long-acting disinfection and sterilization fabric or fiber 孙国明 2022-12-06 CN disclosed