SCHEMBL9384187

SCHEMBL9384187

O=C(Nc1ccccn1)c1ccccn1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 10/20 0.72
▸ RAB9A P51151 10/20 0.72
▸ PKM P14618 2/20 0.68
▸ SMN1; SMN2 Q16637 5/20 0.66
▸ KDM4E B2RXH2 3/20 0.66
▸ ALDH1A1 P00352 2/20 0.66
▸ TP53 P04637 2/20 0.66
▸ NFKB1 P19838 2/20 0.66
▸ NFKB2 Q00653 2/20 0.66
▸ RELA Q04206 2/20 0.66
▸ TSHR P16473 1/20 0.66
▸ GAA P10253 2/20 0.65
▸ MAPT P10636 1/20 0.65
▸ HPGD P15428 1/20 0.65
▸ NPSR1 Q6W5P4 1/20 0.65
▸ HSD17B10 Q99714 1/20 0.65
▸ ATG4B Q9Y4P1 1/20 0.65
▸ GRM5 P41594 3/20 0.64
▸ KMT2A Q03164 3/20 0.64
▸ MEN1 O00255 2/20 0.64

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
SCHEMBL2465497 0.86 GRM5 (0.67) NPC1RAB9APKMSMN1; SMN2KDM4E
SCHEMBL16996703 0.85 NPC1 (0.62) NPC1RAB9APKMSMN1; SMN2KDM4E
SCHEMBL2100277 0.85 NPC1 (0.58) NPC1RAB9APKMSMN1; SMN2KDM4E
SCHEMBL29580683 0.84 NPC1 (0.53) NPC1RAB9APKMSMN1; SMN2KDM4E
SCHEMBL6646671 0.84 NPC1 (0.62) NPC1RAB9APKMSMN1; SMN2KDM4E
SCHEMBL946786 0.84 KMT2A (0.62) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL3859292 0.84 GRM5 (0.65) NPC1RAB9APKMSMN1; SMN2KDM4E
SCHEMBL31277543 0.84 GRM5 (0.65) NPC1RAB9APKMSMN1; SMN2KDM4E
SCHEMBL3870512 0.84 GRM5 (0.74) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL23388826 0.83 SMN1; SMN2 (0.61) NPC1RAB9APKMSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024246946-A1 NOVEL PYRIDINE CARBOXAMIDE COMPOUNDS WITH ANTI-TUBERCULAR ACTIVITY TRANSLATIONAL HEALTH SCIENCE AND TECHNOLOGY INSTITUTE (IN) 2024-12-05 — — WO claimed
EP-4006035-B1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS FOR THE TREATMENT OF CANCER NEUPHARMA INC (US) 2023-11-22 — — EP claimed
CN-111868037-B Fused cyclic urea derivatives as CRHR2 antagonists 拉夸里亚创药株式会社 2023-10-13 — — CN claimed
EP-3774739-B1 FUSED CYCLIC UREA DERIVATIVES AS CRHR2 ANTAGONIST RAQUALIA PHARMA INC (JP) 2022-05-11 — — EP claimed
EP-0389189-B1 Diazepine antiallergy agents PFIZER LTD (GB) 1994-05-18 — — EP claimed
EP-3986465-B1 SITE-SPECIFIC, KINETICALLY INERT CONJUGATION OF LABELS AND/OR CARRIERS TO TARGET MOLECULES SUCH AS HIS-TAGGED PROTEINS VIA METAL COMPLEX REAGENTS MAX PLANCK GESELLSCHAFT (DE) 2026-05-13 — — EP disclosed
US-12497422-B2 Site-specific, kinetically inert conjugation of labels and/or carriers to target molecules such as His-tagged proteins via metal complex reagents Max-Planck-Gesellschaft zur Förderung der Wissenschaften e. V. (DE) 2025-12-16 — — US disclosed
US-12497423-B2 Site-specific, kinetically inert conjugation of labels and/or carriers to target molecules such as his-tagged proteins via metal complex reagents MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2025-12-16 — — US disclosed
US-20250214964-A1 COMPOUNDS DERIVED FROM 4-AMINO-N-(4-AMINOPHENYL) BENZAMIDE AND ANALOGUES AND USE THEREOF CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2025-07-03 — — US disclosed
WO-2024246946-A1 NOVEL PYRIDINE CARBOXAMIDE COMPOUNDS WITH ANTI-TUBERCULAR ACTIVITY TRANSLATIONAL HEALTH SCIENCE AND TECHNOLOGY INSTITUTE (IN) 2024-12-05 — — WO disclosed
CN-111868037-B Fused cyclic urea derivatives as CRHR2 antagonists 拉夸里亚创药株式会社 2023-10-13 — — CN disclosed
WO-2023166232-A1 COMPOUNDS DERIVED FROM 4-AMINO-N-(4-AMINOPHENYL)BENZAMIDE AND ANALOGUES AND USE THEREOF CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2023-09-07 — — WO disclosed
US-20220324893-A1 SITE-SPECIFIC, KINETICALLY INERT CONJUGATION OF LABELS AND/OR CARRIERS TO TARGET MOLECULES SUCH AS HIS-TAGGED PROTEINS VIA METAL COMPLEX REAGENTS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-10-13 — — US disclosed
US-20220306670-A1 SITE-SPECIFIC, KINETICALLY INERT CONJUGATION OF LABELS AND/OR CARRIERS TO TARGET MOLECULES SUCH AS HIS-TAGGED PROTEINS VIA METAL COMPLEX REAGENTS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2022-09-29 — — US disclosed
EP-3986466-A1 SITE-SPECIFIC, KINETICALLY INERT CONJUGATION OF LABELS AND/OR CARRIERS TO TARGET MOLECULES SUCH AS HIS-TAGGED PROTEINS VIA METAL COMPLEX REAGENTS Max-Planck-Gesellschaft zur Förderung der Wissenschaften E. V. (DE) 2022-04-27 — — EP disclosed
EP-3986465-A1 SITE-SPECIFIC, KINETICALLY INERT CONJUGATION OF LABELS AND/OR CARRIERS TO TARGET MOLECULES SUCH AS HIS-TAGGED PROTEINS VIA METAL COMPLEX REAGENTS Max-Planck-Gesellschaft zur Förderung der Wissenschaften E. V. (DE) 2022-04-27 — — EP disclosed
WO-2020254540-A1 SITE-SPECIFIC, KINETICALLY INERT CONJUGATION OF LABELS AND/OR CARRIERS TO TARGET MOLECULES SUCH AS HIS-TAGGED PROTEINS VIA METAL COMPLEX REAGENTS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2020-12-24 — — WO disclosed
WO-2020254539-A1 SITE-SPECIFIC, KINETICALLY INERT CONJUGATION OF LABELS AND/OR CARRIERS TO TARGET MOLECULES SUCH AS HIS-TAGGED PROTEINS VIA METAL COMPLEX REAGENTS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2020-12-24 — — WO disclosed
WO-2020149574-A1 LIQUID CRYSTAL ALIGNMENT COMPOSITION, METHOD OF PREPARING LIQUID CRYSTAL ALIGNMENT FILM USING SAME, AND LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY USING SAME 주식회사 엘지화학 2020-07-23 — — WO disclosed
CN-1043344-C New heterocyclic compounds KRONSEDER MASCHF KRONES (JP) 1999-05-12 — — 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 (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-20250214964-A1 COMPOUNDS DERIVED FROM 4-AMINO-N-(4-AMINOPHENYL) BENZAMIDE AND ANALOGUES AND USE THEREOF ABAT, AADAT, AADAC NPC1 1241/4885RAB9A 1234/4885PKM 315/4885

“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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