SCHEMBL1653308

SCHEMBL1653308

C=C(C)C(=O)OCCCCCCCCCCCCCCOP(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.62
LPAR3 Q9UBY5 8/20 0.53
LPAR2 Q9HBW0 6/20 0.53
LPAR1 Q92633 4/20 0.53
POLB P06746 1/20 0.48
APEX1 P27695 1/20 0.48
HTT P42858 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
THRB P10828 1/20 0.46
ALDH1A1 P00352 1/20 0.40
BTN3A1 O00481 1/20 0.36

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
SCHEMBL30617843 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL15795 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL346866 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL15166 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL345787 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL345385 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL346923 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL1651991 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL345903 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB
SCHEMBL345072 1.00 TSHR (0.62) TSHRLPAR3LPAR2LPAR1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2308453-B1 PRIMER COMPOSITION FOR METAL OXIDE CERAMICS TOKUYAMA DENTAL CORP (JP) 2014-11-12 EP disclosed
US-8790741-B2 Primer composition for metal oxide ceramics TOKUYAMA DENTAL CORPORATION (JP) 2014-07-29 US disclosed
US-20110143015-A1 PRIMER COMPOSITION FOR METAL OXIDE CERAMICS TOKUYAMA DENTAL CORPORATION 2011-06-16 US disclosed
EP-2308453-A1 PRIMER COMPOSITION FOR METAL OXIDE CERAMICS Tokuyama Dental Corporation (JP) 2011-04-13 EP disclosed
US-6265508-B1 Metal surface treatment agent having thiophenecarboxylic acid ester-containing and phosphoric acid ester-containing polymerizable monomer groups GC CORPORATION (JP) 2001-07-24 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-20110143015-A1 PRIMER COMPOSITION FOR METAL OXIDE CERAMICS TERT, TMCO1, MED1 TSHR 2876/4885LPAR3 3664/4885LPAR2 3549/4885

“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.