SCHEMBL21996121

SCHEMBL21996121

CC=CC=CC=CCCC=CC=CC=CC

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.45
CNR1 P21554 7/20 0.45
TRPA1 O75762 2/20 0.44
TRPV1 Q8NER1 1/20 0.44
ALDH1A1 P00352 2/20 0.42
PPARG P37231 2/20 0.42
PPARD Q03181 2/20 0.42
PPARA Q07869 2/20 0.42
SOAT1 P35610 1/20 0.36
TSHR P16473 1/20 0.35
MAPK1 P28482 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
SCHEMBL8438876 0.94 CNR2 (0.42) CNR2CNR1TRPA1TRPV1ALDH1A1
SCHEMBL8438874 0.94 CNR2 (0.42) CNR2CNR1TRPA1TRPV1ALDH1A1
SCHEMBL26624981 0.90 CNR2 (0.41) CNR2CNR1TRPA1TRPV1ALDH1A1
SCHEMBL15256903 0.86 ALDH1A1 (0.46) CNR2CNR1TRPA1TRPV1ALDH1A1
SCHEMBL15879127 0.86 CNR2 (0.39) CNR2CNR1TRPA1TRPV1ALDH1A1
SCHEMBL31635596 0.86 CNR2 (0.39) CNR2CNR1TRPA1TRPV1ALDH1A1
SCHEMBL15305056 0.86 CNR2 (0.39) CNR2CNR1TRPA1TRPV1ALDH1A1
SCHEMBL15879130 0.86 CNR2 (0.39) CNR2CNR1TRPA1TRPV1ALDH1A1
SCHEMBL732601 0.84 ALDH1A1 (0.41) CNR2CNR1TRPA1TRPV1ALDH1A1
SCHEMBL10282163 0.84 ALDH1A1 (0.41) CNR2CNR1TRPA1TRPV1ALDH1A1

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
US-20250025566-A1 PEPTIDE-DRUG CONJUGATES FOR TREATMENT OF NEURODEGENERATIVE DISEASES Københavns Universitet (DK) 2025-01-23 US disclosed
CN-118510545-A Peptide-drug conjugates for the treatment of neurodegenerative diseases 哥本哈根大学 2024-08-16 CN disclosed
US-20210401776-A1 METHOD OF TREATING REFRACTORY EPILEPSY SYNDROMES USING FENFLURAMINE ENANTIOMERS ZOGENIX INTERNATIONAL LIMITED (GB) 2021-12-30 US disclosed
EP-3887481-A1 A METHOD OF TREATING REFRACTORY EPILEPSY SYNDROMES USING FENFLURAMINE ENANTIOMERS Zogenix International Limited (GB) 2021-10-06 EP disclosed
WO-2020112460-A1 A METHOD OF TREATING REFRACTORY EPILEPSY SYNDROMES USING FENFLURAMINE ENANTIOMERS ZOGENIX INTERNATIONAL LIMITED (GB) 2020-06-04 WO 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-20210401776-A1 METHOD OF TREATING REFRACTORY EPILEPSY SYNDROMES USING FENFLURAMINE ENANTIOMERS EPM2A, TPH1, TPH2 CNR2 256/4885CNR1 452/4885TRPA1 3177/4885

“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.