SCHEMBL22632056

SCHEMBL22632056

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

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 6/20 0.47
▸ PPARG P37231 3/20 0.40
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ EP300 Q09472 1/20 0.38
▸ KAT2B Q92831 1/20 0.38
▸ KAT5 Q92993 1/20 0.38
▸ KAT8 Q9H7Z6 1/20 0.38
▸ PTGIR P43119 1/20 0.35
▸ CYP2D6 P10635 1/20 0.34
▸ FAAH O00519 1/20 0.34
▸ EPHX2 P34913 1/20 0.34

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
SCHEMBL22632071 0.90 PPARA (0.54) PPARAPPARGCNR1CNR2PTGIR
SCHEMBL18794618 0.81 PPARA (0.59) PPARAPPARGCNR1CNR2PTGIR
SCHEMBL17465386 0.80 PPARA (0.49) PPARAPPARGEP300KAT2BKAT5
SCHEMBL29983667 0.78 ALDH1A1 (0.50) PPARAPPARGEP300KAT2BKAT5
SCHEMBL22610063 0.78 ALDH1A1 (0.50) PPARAPPARGEP300KAT2BKAT5
SCHEMBL17263526 0.78 ALDH1A1 (0.50) PPARAPPARGEP300KAT2BKAT5
SCHEMBL16984604 0.76 PPARA (0.51) PPARAPPARGCNR1FAAHEPHX2
SCHEMBL17465385 0.75 PPARA (0.49) PPARAPPARGCNR1PTGIRCYP2D6
SCHEMBL4449661 0.73 PPARA (0.55) PPARAPPARGCNR1EP300KAT2B
SCHEMBL26430086 0.73 PPARA (0.55) PPARAPPARGCNR1EP300KAT2B

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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