SCHEMBL1109646

SCHEMBL1109646

O=P(O)(O)Oc1cccc(CCO)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.54
CYP4A11 Q02928 3/20 0.54
SRC P12931 2/20 0.51
INPPL1 O15357 4/20 0.45
INPP5A Q14642 4/20 0.45
PLK1 P53350 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
IDUA P35475 1/20 0.40
INPP5B P32019 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
ACHE P22303 2/20 0.38

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
SCHEMBL28884101 0.86 SRC (0.54) SRCINPPL1INPP5APLK1IDUA
SCHEMBL4336266 0.82 SRC (0.54) SRCINPPL1INPP5APLK1IDUA
SCHEMBL8388022 0.82 SRC (0.55) CYP4F2CYP4A11SRCINPPL1INPP5A
SCHEMBL29648269 0.82 PLK1 (0.57) SRCINPPL1INPP5APLK1
SCHEMBL15049836 0.81 PLK1 (0.62) PLK1
SCHEMBL12344129 0.81 SRC (0.53) SRCINPPL1INPP5APLK1TDP1
SCHEMBL27826220 0.81 SRC (0.53) SRCINPPL1INPP5APLK1IDUA
SCHEMBL9162999 0.81 SRC (0.53) CYP4F2CYP4A11SRCINPPL1INPP5A
SCHEMBL15638466 0.80 PLK1 (0.65) PLK1
SCHEMBL130697 0.79 INPPL1 (0.71) SRCINPPL1INPP5APLK1INPP5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2280032-B1 PHOTOPOLYMERIZABLE COMPOSITIONS TOKUYAMA DENTAL CORP (JP) 2015-01-07 EP disclosed
US-8394869-B2 Photopolymerizable compositions useful as a dental restorative material TOKUYAMA DENTAL CORPORATION (JP) 2013-03-12 US disclosed
US-20110172323-A1 PHOTOPOLYMERIZABLE COMPOSITIONS TOKUYAMA DENTAL CORPORATION (JP) 2011-07-14 US disclosed
EP-2280032-A1 PHOTOPOLYMERIZABLE COMPOSITIONS Tokuyama Dental Corporation (JP) 2011-02-02 EP disclosed
US-5260476-A Dental restoration TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1993-11-09 US disclosed
US-5171763-A A dental composite of a monomer containing poly(3,4-carboxylic benzoic acid and acrylic ester moities, an ion leachable filler and an initiator; high adhesion and strength; discoloration inhibition TOKUYAMA SODA KABUSHIKI KAISHA (JP) 1992-12-15 US 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-20110172323-A1 PHOTOPOLYMERIZABLE COMPOSITIONS RARA, RARB, RARG CYP4F2 2208/4885CYP4A11 1426/4885SRC 3948/4885

“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.