SCHEMBL21808185

SCHEMBL21808185

CC(=O)N1CCN(C(=O)Oc2cc(C)nn2-c2ccccc2)[C@@H](C)C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.46
▸ FAAH O00519 2/20 0.42
▸ P2RY12 Q9H244 6/20 0.42
▸ P2RY1 P47900 1/20 0.40
▸ NTRK1 P04629 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ PDK1 Q15118 1/20 0.38
▸ PDK2 Q15119 1/20 0.38
▸ PDK3 Q15120 1/20 0.38
▸ PDK4 Q16654 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL23668125 1.00 TSHR (0.46) TSHRFAAHP2RY12P2RY1NTRK1
SCHEMBL21808184 1.00 TSHR (0.46) TSHRFAAHP2RY12P2RY1NTRK1
SCHEMBL21808191 0.85 TSHR (0.41) TSHRFAAHP2RY12NTRK1
SCHEMBL21808190 0.85 TSHR (0.41) TSHRFAAHP2RY12NTRK1
SCHEMBL21808189 0.85 TSHR (0.41) TSHRFAAHP2RY12NTRK1
SCHEMBL23668148 0.85 TSHR (0.41) TSHRFAAHP2RY12NTRK1
SCHEMBL23668145 0.85 TSHR (0.41) TSHRFAAHP2RY12NTRK1
SCHEMBL23668146 0.85 TSHR (0.41) TSHRFAAHP2RY12NTRK1
Hydrochloric Acid SCHEMBL23668126 0.85 TSHR (0.40) TSHRFAAHP2RY12NTRK1
Hydrochloric Acid SCHEMBL23668128 0.85 TSHR (0.40) TSHRFAAHP2RY12NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11427547-B2 Edaravone prodrug compound and pharmaceutical use thereof in treatment or alleviation of neurodegenerative or motor neuron disease J2H BIOTECH INC. (KR) 2022-08-30 — — US claimed
US-20220033359-A1 EDARAVONE PRODRUG COMPOUND AND PHARMACEUTICAL USE THEREOF IN TREATMENT OR ALLEVIATION OF NEURODEGENERATIVE OR MOTOR NEURON DISEASE Theragen Etex Co., Ltd (KR) 2022-02-03 — — US claimed
EP-3854787-A1 EDARAVONE PRODRUG COMPOUND AND PHARMACEUTICAL USE THEREOF IN TREATMENT OR ALLEVIATION OF NEURODEGENERATIVE OR MOTOR NEURON DISEASE J2H Biotech Inc. (KR) 2021-07-28 — — EP claimed
CN-112714760-A Edaravone prodrug compound and medical application thereof in treating or improving neurodegenerative or motor neuron diseases J2H生物科技有限公司 2021-04-27 — — CN claimed
WO-2020060092-A1 EDARAVONE PRODRUG COMPOUND AND PHARMACEUTICAL USE THEREOF IN TREATMENT OR ALLEVIATION OF NEURODEGENERATIVE OR MOTOR NEURON DISEASE 제이투에이치바이오텍 주식회사 2020-03-26 — — WO claimed
US-11427547-B2 Edaravone prodrug compound and pharmaceutical use thereof in treatment or alleviation of neurodegenerative or motor neuron disease J2H BIOTECH INC. (KR) 2022-08-30 — — US disclosed
US-20220033359-A1 EDARAVONE PRODRUG COMPOUND AND PHARMACEUTICAL USE THEREOF IN TREATMENT OR ALLEVIATION OF NEURODEGENERATIVE OR MOTOR NEURON DISEASE Theragen Etex Co., Ltd (KR) 2022-02-03 — — US disclosed
US-20220033359-A1 EDARAVONE PRODRUG COMPOUND AND PHARMACEUTICAL USE THEREOF IN TREATMENT OR ALLEVIATION OF NEURODEGENERATIVE OR MOTOR NEURON DISEASE Theragen Etex Co., Ltd (KR) 2022-02-03 — — US disclosed
EP-3854787-A1 EDARAVONE PRODRUG COMPOUND AND PHARMACEUTICAL USE THEREOF IN TREATMENT OR ALLEVIATION OF NEURODEGENERATIVE OR MOTOR NEURON DISEASE J2H Biotech Inc. (KR) 2021-07-28 — — EP disclosed
CN-112714760-A Edaravone prodrug compound and medical application thereof in treating or improving neurodegenerative or motor neuron diseases J2H生物科技有限公司 2021-04-27 — — CN disclosed
WO-2020060092-A1 EDARAVONE PRODRUG COMPOUND AND PHARMACEUTICAL USE THEREOF IN TREATMENT OR ALLEVIATION OF NEURODEGENERATIVE OR MOTOR NEURON DISEASE 제이투에이치바이오텍 주식회사 2020-03-26 — — 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 (2 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-11427547-B2 Edaravone prodrug compound and pharmaceutical use thereof in treatment or alleviation of neurodegenerative or motor neuron disease SMN1; SMN2, NLN, EDNRA TSHR 4538/4885FAAH 2983/4885P2RY12 1560/4885
US-20220033359-A1 EDARAVONE PRODRUG COMPOUND AND PHARMACEUTICAL USE THEREOF IN TREATMENT OR ALLEVIATION OF NEURODEGENERATIVE OR MOTOR NEURON DISEASE SMN1; SMN2, NLN, EDNRA TSHR 4538/4885FAAH 2983/4885P2RY12 1560/4885

“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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