SCHEMBL4068245

SCHEMBL4068245

CCCCCCCCCCC(O)P(=O)(OCC)OCC

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.47
FDPS P14324 4/20 0.47
LAP3 P28838 1/20 0.44
LPAR3 Q9UBY5 3/20 0.42
GPR84 Q9NQS5 3/20 0.42
LPAR1 Q92633 2/20 0.42
LPAR2 Q9HBW0 2/20 0.42
FFAR1 O14842 1/20 0.42
SGPL1 O95470 3/20 0.42

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
SCHEMBL9492034 0.98 FDPS (0.45) SMPD1FDPSLAP3LPAR3LPAR1
SCHEMBL27288704 0.87 LPAR3 (0.45) SMPD1FDPSLPAR3LPAR1LPAR2
SCHEMBL2821620 0.84 POLB (0.44) FDPS
SCHEMBL1863534 0.83 POLB (0.39) SMPD1
SCHEMBL4459817 0.82 PPARD (0.42)
SCHEMBL2816368 0.81 SMPD1 (0.43) SMPD1FDPSLAP3LPAR3LPAR1
SCHEMBL27585706 0.79 LPAR3 (0.50) LPAR3LPAR1LPAR2
SCHEMBL15353194 0.78 SMPD1 (0.44) SMPD1FDPSLAP3LPAR3LPAR1
SCHEMBL4453625 0.78 PPARD (0.45)
SCHEMBL4158111 0.77 LAP3 (0.58) SMPD1FDPSLAP3

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
US-8846978-B2 Electronic devices comprising novel phosphonic acid surface modifiers IMPERIAL INNOVATIONS LTD. (GB) 2014-09-30 US disclosed
US-20120114974-A1 ELECTRONIC DEVICES COMPRISING NOVEL PHOSPHONIC ACID SURFACE MODIFIERS NATIONAL SCIENCE FOUNDATION 2012-05-10 US disclosed
WO-2010115854-A1 ELECTRONIC DEVICES COMPRISING NOVEL PHOSPHONIC ACID SURFACE MODIFIERS GEORGIA TECH RESEARCH CORPORATION (US) 2010-10-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120114974-A1 ELECTRONIC DEVICES COMPRISING NOVEL PHOSPHONIC ACID SURFACE MODIFIERS EFNA1, PHOSPHO1, EPHA6 SMPD1 3905/4885FDPS 4095/4885LAP3 3300/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.