SCHEMBL21808515

SCHEMBL21808515

Cc1cc(OC(=O)N2CCN(C(=O)[C@H](C)N)CC2)n(-c2ccccc2)n1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 6/20 0.43
▸ GAA P10253 3/20 0.42
▸ NTRK1 P04629 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ TSHR P16473 3/20 0.41
▸ KMT2A Q03164 1/20 0.40
▸ P2RY1 P47900 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL23668130 1.00 P2RY12 (0.43) P2RY12GAANTRK1CYP1A2MAPK1
Hydrochloric Acid SCHEMBL23668150 0.99 P2RY12 (0.42) P2RY12GAANTRK1CYP1A2MAPK1
Hydrochloric Acid SCHEMBL23668149 0.99 P2RY12 (0.42) P2RY12GAANTRK1CYP1A2MAPK1
SCHEMBL23668164 0.91 P2RY12 (0.42) P2RY12GAANTRK1CYP1A2MAPK1
SCHEMBL21808183 0.91 P2RY12 (0.42) P2RY12GAANTRK1CYP1A2MAPK1
Hydrochloric Acid SCHEMBL23668159 0.90 P2RY12 (0.41) P2RY12GAANTRK1CYP1A2MAPK1
Hydrochloric Acid SCHEMBL21808316 0.90 P2RY12 (0.41) P2RY12GAANTRK1CYP1A2MAPK1
SCHEMBL23668162 0.88 ALDH1A1 (0.44) P2RY12GAANTRK1CYP1A2MAPK1
SCHEMBL23668142 0.88 P2RY12 (0.43) P2RY12GAANTRK1TSHRKMT2A
SCHEMBL23668144 0.88 P2RY12 (0.43) P2RY12GAANTRK1TSHRKMT2A

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 P2RY12 1560/4885GAA 37/4885NTRK1 1439/4885
US-20220033359-A1 EDARAVONE PRODRUG COMPOUND AND PHARMACEUTICAL USE THEREOF IN TREATMENT OR ALLEVIATION OF NEURODEGENERATIVE OR MOTOR NEURON DISEASE SMN1; SMN2, NLN, EDNRA P2RY12 1560/4885GAA 37/4885NTRK1 1439/4885

“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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