SCHEMBL186601

SCHEMBL186601

CNc1ccncc1[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
HTT P42858 3/20 0.58
RAB9A P51151 1/20 0.58
GAA P10253 1/20 0.57
MAPT P10636 1/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
HCAR3 P49019 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.43
KDM4C Q9H3R0 1/20 0.43
MAPK1 P28482 1/20 0.41
AOC1 P19801 1/20 0.41
AOC3 Q16853 1/20 0.41
GALR2 O43603 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL30239656 1.00 ALDH1A1 (0.61) ALDH1A1HTTRAB9AGAAMAPT
SCHEMBL18232337 0.85 ALDH1A1 (0.49) ALDH1A1HTTRAB9AGAAMAPT
SCHEMBL27755590 0.81 ALDH1A1 (0.61) ALDH1A1HTTRAB9AGAAMAPT
SCHEMBL28801025 0.81 ALDH1A1 (0.61) ALDH1A1HTTRAB9AGAAMAPT
SCHEMBL9469139 0.81 ALDH1A1 (0.61) ALDH1A1HTTRAB9AGAAMAPT
SCHEMBL10283705 0.81 KDM4C (0.47) ALDH1A1HTTRAB9AGAAMAPT
SCHEMBL23852951 0.81 ALDH1A1 (0.56) ALDH1A1HTTRAB9AGAAMAPT
SCHEMBL2337025 0.81 ALDH1A1 (0.56) ALDH1A1HTTRAB9AGAAMAPT
SCHEMBL16657359 0.81 ALDH1A1 (0.56) ALDH1A1HTTRAB9AGAAMAPT
SCHEMBL9426306 0.80 ALDH1A1 (0.55) ALDH1A1HTTRAB9AGAAMAPT

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 121 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12552811-B2 Immunosuppressant, and preparation method therefor and use thereof ABBISKO THERAPEUTICS CO., LTD. (CN) 2026-02-17 US disclosed
US-12473282-B2 Biphenyl fluorine double bond derivative, preparation method therefor, and pharmaceutical application thereof ABBISKO THERAPEUTICS CO., LTD. (CN) 2025-11-18 US disclosed
CN-115605475-B Immunosuppressant, preparation method and application thereof 上海和誉生物医药科技有限公司 2025-03-25 CN disclosed
CN-118994208-B Preparation method of biphenyl derivatives 江苏豪森药业集团有限公司 2025-02-11 CN disclosed
CN-118994208-A Preparation method of biphenyl derivatives 江苏豪森药业集团有限公司 2024-11-22 CN disclosed
US-20240376076-A1 INHIBITORS TARGETING UBIQUITIN SPECIFIC PROTEASE 7 (USP7) DANA-FARBER CANCER INSTITUTE, INC. 2024-11-14 US disclosed
CN-118401507-A Inhibitors targeting ubiquitin-specific protease 7 (USP 7) 丹娜法伯癌症研究院 2024-07-26 CN disclosed
CN-114502556-B Biphenyl fluoro double bond derivative, preparation method thereof and application thereof in pharmacy 上海和誉生物医药科技有限公司 2023-07-28 CN disclosed
US-20230234970-A1 IMMUNOSUPPRESSANT, AND PREPARATION METHOD THEREFOR AND USE THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2023-07-27 US disclosed
US-20230234970-A1 IMMUNOSUPPRESSANT, AND PREPARATION METHOD THEREFOR AND USE THEREOF ABBISKO THERAPEUTICS CO., LTD. (CN) 2023-07-27 US disclosed
WO-2003011864-A1 DERIVATIVES OF TRIAZOLYL-IMIDAZOPYRIDINE AND OF THE TRIAZOLYLPURINES USEFUL AS LIGANDS OF THE ADENOSINE A2a RECEPTOR AND THEIR USE AS MEDICAMENTS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2003-02-13 WO disclosed
WO-2003011864-A1 DERIVATIVES OF TRIAZOLYL-IMIDAZOPYRIDINE AND OF THE TRIAZOLYLPURINES USEFUL AS LIGANDS OF THE ADENOSINE A2a RECEPTOR AND THEIR USE AS MEDICAMENTS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2003-02-13 WO disclosed
US-5723468-A COGNITION ACTIVATORS FOR MEMOY LOSS AMERICAN HOME PRODUCTS CORPORATION (US) 1998-03-03 US disclosed
US-5571819-A Imidazopyridines as muscarinic agents WYETH 1996-11-05 US disclosed
US-5371086-A Circulatory disorders side effect reduction THE GREEN CROSS CORPORATION (JP) 1994-12-06 US disclosed
US-5262415-A FOR TREATING DISEASES OF THE CIRCULATORY SYSTEM THE GREEN CROSS CORPORATION (JP) 1993-11-16 US disclosed
EP-0503627-A1 Aminopyridine compounds THE GREEN CROSS CORPORATION (JP) 1992-09-16 EP disclosed
US-4654350-A Gaba-agonistic imidazo(4,5-c)pyridines useful as pharmaceuticals MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1987-03-31 US disclosed
EP-0082369-B1 IMIDAZO (4,5-C) PYRIDINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR THEIR PREPARATION MERCK PATENT GmbH (DE) 1986-04-09 EP disclosed
EP-0082369-A1 Imidazo (4,5-c) pyridines, pharmaceutical compositions containing them and process for their preparation MERCK PATENT GmbH (DE) 1983-06-29 EP 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 (4 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-12552811-B2 Immunosuppressant, and preparation method therefor and use thereof CD274, PDCD1, PDCD1LG2 ALDH1A1 341/4885HTT 4192/4885RAB9A 2060/4885
US-12473282-B2 Biphenyl fluorine double bond derivative, preparation method therefor, and pharmaceutical application thereof PDCD1, CD274, PDCD1LG2 ALDH1A1 171/4885HTT 3776/4885RAB9A 2254/4885
US-20230234970-A1 IMMUNOSUPPRESSANT, AND PREPARATION METHOD THEREFOR AND USE THEREOF CD274, PDCD1, PDCD1LG2 ALDH1A1 106/4885HTT 3993/4885RAB9A 1896/4885
US-20240376076-A1 INHIBITORS TARGETING UBIQUITIN SPECIFIC PROTEASE 7 (USP7) USP7, USP47, USP2 ALDH1A1 2692/4885HTT 1016/4885RAB9A 1457/4885

“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.