SCHEMBL28061503

SCHEMBL28061503

CCN(CC)OP(=O)(O)O.[NaH]

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP8 P22894 1/20 0.37
LPAR3 Q9UBY5 3/20 0.33
LPAR1 Q92633 2/20 0.33
LPAR2 Q9HBW0 2/20 0.33
BLM P54132 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SMPD1 P17405 3/20 0.30
PPARD Q03181 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
SCHEMBL566174 0.97 FDPS (0.39) FDPSMMP1MMP2MMP3MMP8
Ethylene SCHEMBL28834773 0.92 FDPS (0.36) FDPSMMP1MMP2MMP3MMP8
SCHEMBL14782321 0.80 GABBR2 (0.33) FDPSMMP1MMP2MMP3MMP8
SCHEMBL5953931 0.79 FDPS (0.37) FDPSMMP1MMP2MMP3MMP8
SCHEMBL9483293 0.78 BTN3A1 (0.39) FDPSMMP1MMP2MMP3MMP8
SCHEMBL9772400 0.77 FDPS (0.36) FDPSMMP1MMP2MMP3MMP8
SCHEMBL28304867 0.77 FDPS (0.43) FDPSMMP1MMP2MMP3MMP8
SCHEMBL27723302 0.74
SCHEMBL9328046 0.73 TSHR (0.40) FDPSMMP1MMP2MMP3MMP8
SCHEMBL1230592 0.73 MMP1 (0.47) FDPSMMP1MMP2MMP3MMP8

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118109065-A Preparation method and application of composite titanium dioxide 宜兴市凯乐新材料科技有限公司 2024-05-31 CN claimed
CN-118109065-A Preparation method and application of composite titanium dioxide 宜兴市凯乐新材料科技有限公司 2024-05-31 CN disclosed
CN-105527361-A High-efficiency microflow electrochromatography similarity analysis method and influence degree calculating method SHANGHAI INST OF COMPUTING TECH 2016-04-27 CN disclosed