SCHEMBL23521941

SCHEMBL23521941

O=C(NCc1cccc(Cl)c1)c1nccnn1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.56
▸ MEN1 O00255 1/20 0.51
▸ HCRTR1 O43613 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ POLB P06746 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ APEX1 P27695 1/20 0.47
▸ HDAC3 O15379 1/20 0.47
▸ HDAC1 Q13547 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ MAOB P27338 1/20 0.46
▸ MMP13 P45452 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPK3 P27361 1/20 0.46
▸ MAPK1 P28482 1/20 0.46

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
SCHEMBL29807934 1.00 NPC1 (0.56) NPC1MEN1HCRTR1KMT2APOLB
SCHEMBL28687576 0.85 ROCK2 (0.54) KMT2ALMNAHDAC1MMP13MAPK1
SCHEMBL30592138 0.84 MMP13 (0.60) KMT2APOLBLMNAMAOBMMP13
SCHEMBL23521923 0.84 MMP13 (0.60) KMT2APOLBLMNAMAOBMMP13
SCHEMBL29808056 0.83 CYP2C19 (0.58) MEN1KMT2APOLBLMNAMAPK1
SCHEMBL23521747 0.83 CYP2C19 (0.58) MEN1KMT2APOLBLMNAMAPK1
SCHEMBL23521924 0.83 KMT2A (0.55) KMT2ALMNAHDAC2HDAC6MMP13
SCHEMBL29808051 0.83 KMT2A (0.55) KMT2ALMNAHDAC2HDAC6MMP13
SCHEMBL23521925 0.83 TSHR (0.51) MEN1KMT2ALMNAAPEX1HDAC1
SCHEMBL29807696 0.83 TSHR (0.51) MEN1KMT2ALMNAAPEX1HDAC1

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
EP-4104902-B1 COMPOUNDS AND MEDICAMENTS USING SAME IRIMAJIRI THERAPEUTICS INC (JP) 2026-05-27 — — EP disclosed
US-11780841-B2 3,6-methano-1H-pyrrolo[3,2-b]pyridine and 3,6-methano-1H-pyrrolo[3,2-c]pyridine compounds and medicaments using same IRIMAJIRI THERAPEUTICS INC. (JP) 2023-10-10 — — US disclosed
EP-3838901-B1 COMPOUND FOR TREATMENT OF RABIES AND METHOD FOR TREATMENT OF RABIES IRIMAJIRI THERAPEUTICS INC (JP) 2023-09-27 — — EP disclosed
EP-4104902-A1 COMPOUND AND DRUG CONTAINING SAME Oita University Institute of Advanced Medicine, Inc. (JP) 2022-12-21 — — EP disclosed
CN-115260193-A Compounds and methods for treating rabies 株式会社大分大学先端医学研究所 2022-11-01 — — CN disclosed
CN-115052661-A Compound and drug using the same 株式会社大分大学先端医学研究所 2022-09-13 — — CN disclosed
CN-112839944-B Compounds and methods for treating rabies 株式会社大分大学先端医学研究所 2022-08-05 — — CN disclosed
US-20220194942-A1 3,6-METHANO-1H-PYRROLO[3,2-b]PYRIDINE AND 3,6-METHANO-1H-PYRROLO[3,2-c]PYRIDINE COMPOUNDS AND MEDICAMENTS USING SAME IRIMAJIRI THERAPEUTICS INC. (JP) 2022-06-23 — — US disclosed
US-11292794-B2 3,6-methano-1H-pyrrolo[3,2-b]pyridine and 3,6-methano-1H-pyrrolo[3,2-C]pyridine compounds and medicaments using same OITA UNIVERSITY INSTITUTE OF ADVANCED MEDICINE, INC. (JP) 2022-04-05 — — US disclosed
EP-3838901-A1 COMPOUND FOR TREATMENT OF RABIES AND METHOD FOR TREATMENT OF RABIES Oita University Institute of Advanced Medicine, Inc. (JP) 2021-06-23 — — EP disclosed
CN-112839944-A Compounds and methods for treating rabies 株式会社大分大学先端医学研究所 2021-05-25 — — CN 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-11292794-B2 3,6-methano-1H-pyrrolo[3,2-b]pyridine and 3,6-methano-1H-pyrrolo[3,2-C]pyridine compounds and medicaments using same AVPR1B, F12, SDHB NPC1 3009/4885MEN1 203/4885HCRTR1 2413/4885
US-11780841-B2 3,6-methano-1H-pyrrolo[3,2-b]pyridine and 3,6-methano-1H-pyrrolo[3,2-c]pyridine compounds and medicaments using same AVPR1B, AVPR2, F12 NPC1 3114/4885MEN1 248/4885HCRTR1 2763/4885
US-20220194942-A1 3,6-METHANO-1H-PYRROLO[3,2-b]PYRIDINE AND 3,6-METHANO-1H-PYRROLO[3,2-c]PYRIDINE COMPOUNDS AND MEDICAMENTS USING SAME AVPR1B, AVPR2, F12 NPC1 3114/4885MEN1 248/4885HCRTR1 2763/4885

“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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