SCHEMBL21646080

SCHEMBL21646080

C#CCNC1=CC(=O)C=CC1=O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 3/20 0.49
▸ MAOB P27338 3/20 0.49
▸ MAPT P10636 2/20 0.33
▸ CA12 O43570 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ ERBB2 P04626 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ ACHE P22303 1/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ CA4 P22748 1/20 0.30

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
SCHEMBL21814436 0.77 ACHE (0.38) MAOAMAOBMAPTERBB2MEN1
SCHEMBL21814428 0.73 ACHE (0.40) MAPTERBB2MEN1ALDH1A1HPGD
SCHEMBL15630516 0.72 ALDH1A1 (0.36) MAOAMAOBMAPTERBB2MEN1
SCHEMBL21814456 0.71 ALDH1A1 (0.51) MAPTERBB2ALDH1A1TDP1ACHE
SCHEMBL10806369 0.69 MAPT (0.42) MAPTERBB2MEN1ALDH1A1HPGD
SCHEMBL21814608 0.69 ACHE (0.49) MAPTMEN1ALDH1A1KMT2AACHE
SCHEMBL7606757 0.69 ERBB2 (0.41) MAOAMAOBMAPTERBB2MEN1
SCHEMBL21814610 0.68 ACHE (0.51) MAPTMEN1ALDH1A1KMT2AACHE
SCHEMBL21814446 0.68 ACHE (0.51) MAPTMEN1ALDH1A1KMT2AACHE
SCHEMBL21818683 0.68 ACHE (0.51) MAPTMEN1ALDH1A1KMT2AACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240041849-A1 COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL OR MITOCHONDRIAL DISEASES MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2024-02-08 — — US disclosed
US-11771685-B2 Compounds for the treatment of neurological or mitochondrial diseases MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2023-10-03 — — US disclosed
US-20220125774-A1 COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL OR MITOCHONDRIAL DISEASES MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2022-04-28 — — US disclosed
EP-3829560-A1 COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL OR MITOCHONDRIAL DISEASES Musc Foundation for Research Development (US) 2021-06-09 — — EP disclosed
CN-112770735-A Compounds for the treatment of neurological or mitochondrial diseases MUSC研究发展基金会 2021-05-07 — — CN disclosed
WO-2020028222-A1 COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL OR MITOCHONDRIAL DISEASES MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2020-02-06 — — 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 (3 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-20240041849-A1 COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL OR MITOCHONDRIAL DISEASES MT-ND2, MT-ND1, NLN MAOA 1603/4885MAOB 1073/4885MAPT 294/4885
US-11771685-B2 Compounds for the treatment of neurological or mitochondrial diseases MT-ND2, MT-ND1, NLN MAOA 1603/4885MAOB 1073/4885MAPT 294/4885
US-20220125774-A1 COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL OR MITOCHONDRIAL DISEASES MT-ND2, MT-ND1, NLN MAOA 1603/4885MAOB 1073/4885MAPT 294/4885

“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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