SCHEMBL2445796

SCHEMBL2445796

Nc1cc(N2CCOCC2)ccc1[N+](=O)[O-]

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.75
MAPT P10636 17/20 0.69
RECQL P46063 1/20 0.69
SIRT6 Q8N6T7 1/20 0.69
PKM P14618 1/20 0.69
ALDH1A1 P00352 7/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
NPSR1 Q6W5P4 1/20 0.64
MAPK1 P28482 3/20 0.57
CYP2C9 P11712 1/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
HPGD P15428 1/20 0.55
LGMN Q99538 1/20 0.54

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
SCHEMBL16054143 0.90 LMNA (0.61) LMNAMAPTRECQLSIRT6PKM
SCHEMBL5445416 0.88 MAPT (0.65) LMNAMAPTRECQLSIRT6PKM
SCHEMBL29843690 0.88 MAPT (0.65) LMNAMAPTRECQLSIRT6PKM
Hydrochloric Acid SCHEMBL28515977 0.87 MAPT (0.63) LMNAMAPTRECQLSIRT6PKM
SCHEMBL26423365 0.86 LMNA (0.57) LMNAMAPTRECQLSIRT6PKM
SCHEMBL3109069 0.86 LMNA (1.00) LMNAMAPTRECQLSIRT6ALDH1A1
SCHEMBL30059159 0.86 LMNA (1.00) LMNAMAPTRECQLSIRT6ALDH1A1
SCHEMBL25877527 0.86 LMNA (0.94) LMNAMAPTRECQLSIRT6ALDH1A1
SCHEMBL18036523 0.86 MAPT (0.75) LMNAMAPTPKMALDH1A1SMN1; SMN2
SCHEMBL8074050 0.84 LMNA (0.97) LMNAMAPTRECQLSIRT6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1351946-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2003-10-15 EP claimed
US-20020165218-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. 2002-11-07 US claimed
WO-2002020500-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2002-03-14 WO claimed
WO-2025099451-A1 NEW COMPOUNDS AND METHODS Transition Bio Limited (GB) 2025-05-15 WO disclosed
CN-116217551-B Substituted indazole or azaindazole compounds and application thereof 河南中医药大学 2024-07-30 CN disclosed
US-20240199625-A1 BICYCLIC HETEROCYCLIC FGFR4 INHIBITOR, PHARMACEUTICAL COMPOSITION AND PREPARATION COMPRISING SAME, AND APPLICATION THEREOF HANGZHOU APELOA MEDICINE RESEARCH INSTITUTE CO., LTD. (CN) 2024-06-20 US disclosed
CN-117886798-A Substituted benzimidazoles and use thereof 河南中医药大学 2024-04-16 CN disclosed
EP-4317143-A1 BICYCLIC HETEROCYCLIC FGFR4 INHIBITOR, PHARMACEUTICAL COMPOSITION AND PREPARATION COMPRISING SAME, AND APPLICATION THEREOF Hangzhou Apeloa Medicine Research Institute Co., Ltd. (CN) 2024-02-07 EP disclosed
CN-117062809-A Bicyclic heterocyclic FGFR4 inhibitors, pharmaceutical compositions and formulations comprising the same and uses thereof 杭州普洛药物研究院有限公司 2023-11-14 CN disclosed
CN-116217551-A Substituted indazole or azaindazole compounds and application thereof 河南中医药大学 2023-06-06 CN disclosed
CN-111032643-B Quinolinone compounds 詹森药业有限公司 2023-05-30 CN disclosed
WO-2002022598-A1 QUINOLINONE DERIVATIVES AS TYROSINE KINASE INHIBITORS CHIRON CORPORATION (US) 2002-03-21 WO disclosed
WO-2002020500-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2002-03-14 WO disclosed
WO-2002018383-A2 AZA HETEROCYCLIC DERIVATIVES AND THEIR THERAPEUTIC USE CHIRON CORPORATION (US) 2002-03-07 WO disclosed
US-20010052156-A1 DYES HANS SCHWARZKOPF GMBH & CO. KG (DE) 2001-12-20 US disclosed
US-20010005914-A1 OXIDATION DYES ANDREAS J. BITTNER 2001-07-05 US disclosed
EP-0912160-A2 OXIDATION DYES Hans Schwarzkopf GmbH & Co. KG (DE) 1999-05-06 EP disclosed
EP-0910332-A2 DYES Hans Schwarzkopf GmbH & Co. KG (DE) 1999-04-28 EP disclosed
WO-1998001105-A2 DYES HANS SCHWARZKOPF GMBH & CO. KG (DE) 1998-01-15 WO disclosed
WO-1998001106-A2 OXIDATION DYES HANS SCHWARZKOPF GMBH & CO. KG (DE) 1998-01-15 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 (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-20010052156-A1 DYES KRT18, OPRD1, HTR1D LMNA 2827/4885MAPT 4151/4885RECQL 3478/4885
US-20010005914-A1 OXIDATION DYES AOC1, CBR3, KRT18 LMNA 1692/4885MAPT 3633/4885RECQL 2228/4885
US-20240199625-A1 BICYCLIC HETEROCYCLIC FGFR4 INHIBITOR, PHARMACEUTICAL COMPOSITION AND PREPARATION COMPRISING SAME, AND APPLICATION THEREOF FGFR4, FGFR3, FGFR1 LMNA 3847/4885MAPT 2742/4885RECQL 1971/4885
US-20020165218-A1 Materials and methods to potentiate cancer treatment DCK, CHEK2, CHEK1 LMNA 834/4885MAPT 4502/4885RECQL 366/4885

“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.