SCHEMBL28934860

SCHEMBL28934860

CCCC(Cl)(Cl)OP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 5/20 0.47
FDPS P14324 10/20 0.46
LPAR3 Q9UBY5 3/20 0.34
GGPS1 O95749 3/20 0.34
LPAR1 Q92633 2/20 0.34
LPAR2 Q9HBW0 2/20 0.34
S1PR2 O95136 1/20 0.33
S1PR4 O95977 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 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
Ammonia Solution, Strong SCHEMBL27494116 0.82 SMPD1 (0.62) SMPD1FDPSLPAR3GGPS1LPAR1
SCHEMBL3425546 0.81 SMPD1 (0.41) SMPD1FDPSLPAR3LPAR1LPAR2
SCHEMBL27864075 0.79 SMPD1 (0.35) SMPD1
SCHEMBL11291365 0.77 SMPD1 (0.43) SMPD1FDPSLPAR3GGPS1LPAR1
SCHEMBL5908958 0.76 SMPD1 (0.50) SMPD1FDPSLPAR3GGPS1LPAR1
SCHEMBL11125413 0.75 SMPD1 (0.42) SMPD1FDPSLPAR3GGPS1LPAR1
SCHEMBL5964459 0.74 SMPD1 (0.48) SMPD1FDPSLPAR3GGPS1LPAR1
SCHEMBL1923635 0.74 SMPD1 (0.48) SMPD1FDPSLPAR3GGPS1LPAR1
SCHEMBL11128134 0.74 SMPD1 (0.41) SMPD1FDPSS1PR2S1PR4S1PR1
SCHEMBL10593259 0.73 SMPD1 (0.33) SMPD1FDPS

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