SCHEMBL9999835

SCHEMBL9999835

CCP(=O)(O)OCCCOC

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 10/20 0.43
LPAR2 Q9HBW0 8/20 0.43
LPAR1 Q92633 4/20 0.43
CYP3A4 P08684 1/20 0.39
SAT1 P21673 1/20 0.36
ALDH1A1 P00352 2/20 0.35
PPARD Q03181 1/20 0.35
GAA P10253 1/20 0.33
TSHR P16473 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
SCHEMBL18686723 0.88 LPAR3 (0.54) LPAR3LPAR2LPAR1CYP3A4SAT1
SCHEMBL27637767 0.86 PPARD (0.38) LPAR3LPAR2LPAR1CYP3A4SAT1
SCHEMBL2486762 0.84 CYP3A4 (0.58) LPAR3LPAR2LPAR1CYP3A4ALDH1A1
SCHEMBL18686721 0.83 PPARD (0.42) LPAR3LPAR2LPAR1CYP3A4SAT1
SCHEMBL10020167 0.82 PPARD (0.45) LPAR3LPAR2LPAR1CYP3A4SAT1
SCHEMBL17626529 0.82 CYP3A4 (0.56) LPAR3LPAR2LPAR1CYP3A4ALDH1A1
SCHEMBL777674 0.82 LPAR3 (0.65) LPAR3LPAR2LPAR1CYP3A4
SCHEMBL17626420 0.82 CYP3A4 (0.56) LPAR3LPAR2LPAR1CYP3A4ALDH1A1
SCHEMBL17626575 0.82 CYP3A4 (0.56) LPAR3LPAR2LPAR1CYP3A4ALDH1A1
SCHEMBL10049651 0.82 LPAR3 (0.39) LPAR3LPAR2LPAR1CYP3A4SAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142011-A1 Modified siNA QIAGEN GMBH 2012-06-07 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-20120142011-A1 Modified siNA NSUN2, SIN3A, SNRPA1 LPAR3 2147/4885LPAR2 2422/4885LPAR1 2588/4885

“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.