SCHEMBL17311809

SCHEMBL17311809

NCCCCCC(N)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.36
SMPD1 P17405 3/20 0.36
FDPS P14324 1/20 0.34
S1PR2 O95136 5/20 0.34
S1PR1 P21453 5/20 0.34
S1PR3 Q99500 5/20 0.34
S1PR4 O95977 4/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
KMT2A Q03164 1/20 0.34
LAP3 P28838 1/20 0.33
CPB2 Q96IY4 2/20 0.33
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
NFKB1 P19838 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32

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
SCHEMBL15103121 1.00 GSR (0.36) GSRSMPD1FDPSS1PR2S1PR1
SCHEMBL15103003 1.00 GSR (0.36) GSRSMPD1FDPSS1PR2S1PR1
SCHEMBL15102979 1.00 GSR (0.36) GSRSMPD1FDPSS1PR2S1PR1
SCHEMBL15103151 1.00 GSR (0.36) GSRSMPD1FDPSS1PR2S1PR1
SCHEMBL17311820 0.98 GSR (0.37) GSRSMPD1FDPSS1PR2S1PR1
SCHEMBL17311823 0.93 CYP1A2 (0.36) SMPD1FDPSMEN1CYP1A2KMT2A
SCHEMBL5177953 0.85 SMPD1 (0.44) GSRSMPD1FDPSS1PR2S1PR1
SCHEMBL28459514 0.85 SMPD1 (0.44) GSRSMPD1FDPSS1PR2S1PR1
SCHEMBL15102977 0.85 GABBR2 (0.36) FDPSMEN1CYP1A2KMT2ALMNA
SCHEMBL27722161 0.84 SMPD1 (0.43) GSRSMPD1FDPSS1PR2S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9493353-B2 Process for producing pyrophosphate ADEKA CORPORATION (JP) 2016-11-15 US claimed
US-20250223485-A1 WELLBORE FLUIDS INCLUDING SHALE INHIBITORS, AND RELATED METHODS SCHLUMBERGER TECHNOLOGY CORPORATION 2025-07-10 US disclosed
CN-118772420-B Preparation method and application of non-color-changing halogen-free flame retardant with high-temperature heat stability 四川省成都市福来隆科技有限公司 2024-12-03 CN disclosed
CN-118772420-A Preparation method and application of non-color-changing halogen-free flame retardant with high-temperature heat stability 四川省成都市福来隆科技有限公司 2024-10-15 CN disclosed
CN-114040994-A Method for finishing metal surfaces 3M创新有限公司 2022-02-11 CN disclosed
US-9493353-B2 Process for producing pyrophosphate ADEKA CORPORATION (JP) 2016-11-15 US disclosed
EP-2962989-A1 METHOD FOR PRODUCING PYROPHOSPHATE Adeka Corporation (JP) 2016-01-06 EP disclosed
US-20150353513-A1 PROCESS FOR PRODUCING PYROPHOSPHATE ADEKA CORPORATION (JP) 2015-12-10 US disclosed