SCHEMBL22632071

SCHEMBL22632071

CCC/C=C/C/C=C/CCCCCCCc1cccc(OCCC2CC2O)c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 6/20 0.54
▸ PPARG P37231 3/20 0.47
▸ CNR1 P21554 1/20 0.45
▸ CNR2 P34972 1/20 0.45
▸ PTGIR P43119 1/20 0.41
▸ CYP2D6 P10635 4/20 0.41
▸ EPHX2 P34913 2/20 0.40
▸ FAAH O00519 1/20 0.40

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
SCHEMBL22632056 0.90 PPARA (0.47) PPARAPPARGCNR1CNR2PTGIR
SCHEMBL17424577 0.83 PPARA (0.62) PPARAPPARGCNR1CNR2PTGIR
SCHEMBL14520574 0.81 PPARA (0.59) PPARAPPARGCNR1PTGIRCYP2D6
SCHEMBL12809420 0.78 PPARA (0.55) PPARAPPARGPTGIR
SCHEMBL32675259 0.78 PPARA (0.55) PPARAPPARGPTGIR
SCHEMBL4452302 0.78 PPARA (0.55) PPARAPPARGPTGIR
SCHEMBL13206731 0.77 PPARA (0.58) PPARAPPARGCNR1EPHX2FAAH
SCHEMBL18794618 0.77 PPARA (0.59) PPARAPPARGCNR1CNR2PTGIR
SCHEMBL26338269 0.74 PPARA (0.56) PPARAPPARGCNR1PTGIREPHX2
SCHEMBL20779106 0.73 PPARA (0.57) PPARAPPARGCNR1CNR2PTGIR

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-20200347001-A1 Synthesis of Bio-Based Polyols from Epoxidized Cardanol and Epoxidized Triglyceride by Using Thiol-Containing Reagents THE UNIVERSITY OF AKRON 2020-11-05 — — 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-20200347001-A1 Synthesis of Bio-Based Polyols from Epoxidized Cardanol and Epoxidized Triglyceride by Using Thiol-Containing Reagents GSTO1, FDFT1, DGAT2 PPARA 811/4885PPARG 981/4885CNR1 2645/4885

“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.

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