SCHEMBL5004832

SCHEMBL5004832

CCOc1ccc([N+](=O)[O-])c(C)c1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.69
▸ MAPT P10636 7/20 0.69
▸ LMNA P02545 3/20 0.69
▸ NPC1 O15118 3/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ KDM4E B2RXH2 3/20 0.53
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ HTT P42858 1/20 0.52
▸ MAPK1 P28482 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ HPGD P15428 1/20 0.49

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
SCHEMBL8746685 0.88 MAPT (0.62) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL10870559 0.88 MAPT (0.71) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL1141920 0.87 MAPT (0.70) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL4835421 0.87 MAPT (0.70) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL3721960 0.86 MAPT (0.64) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL11643791 0.86 MAPT (0.78) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL6677275 0.86 MAPT (0.73) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL3026479 0.85 MAPT (0.59) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL10176166 0.84 MAPT (0.71) ALDH1A1MAPTLMNANPC1RAB9A
SCHEMBL8864730 0.84 NPC1 (0.60) ALDH1A1MAPTLMNANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365559-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER AUCKLAND UNISERVICES LIMITED (NZ) 2023-11-16 — — US disclosed
CN-116669725-A Novel aminopyridine and use thereof in the treatment of cancer 奥克兰联合服务有限公司 2023-08-29 — — CN disclosed
EP-4217357-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER Auckland Uniservices Limited (NZ) 2023-08-02 — — EP disclosed
CN-113105475-B Inhibitors of bruton's tyrosine kinase and methods of use thereof 詹森药业有限公司 2022-09-09 — — CN disclosed
WO-2022064430-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER AUCKLAND UNISERVICES LIMITED (NZ) 2022-03-31 — — WO disclosed
CN-113105475-A Inhibitors of bruton's tyrosine kinase and methods of use thereof 詹森药业有限公司 2021-07-13 — — CN disclosed
US-10822348-B2 Inhibitors of Bruton's tyrosine kinase and methods of their use JANSSEN PHARMACEUTICA NV (BE) 2020-11-03 — — US disclosed
US-10800792-B2 Inhibitors of Bruton's tyrosine kinase and method of their use JANSSEN PHARMACEUTICA NV (BE) 2020-10-13 — — US disclosed
US-10689396-B2 Inhibitors of Bruton's tyrosine kinase and methods of their use JANSSEN PHARMACEUTICA NV (BE) 2020-06-23 — — US disclosed
CN-106749045-B D-amino acid oxidase inhibitor and preparation method and application thereof 上海交通大学 2020-02-14 — — CN disclosed
US-4665194-A ANALGESICS, ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1987-05-12 — — US disclosed
US-4658037-A RHEUMATIC DISEASES PFIZER INC. (US) 1987-04-14 — — US disclosed
US-4652658-A Process for making 2-oxindole-1-carboxamides and intermediates therefor PFIZER INC. (US) 1987-03-24 — — US disclosed
EP-0175551-A1 Analgesic and antiinflammatory 1,3-diacyl-2-oxindole compounds PFIZER INC. (US) 1986-03-26 — — EP disclosed
US-4569942-A N,3-Disubstituted 2-oxindole-1-carboxamides as analgesic and antiinflammatory agents PFIZER INC. (US) 1986-02-11 — — US disclosed
EP-0164860-A1 N,3-disubstituted 2-oxindole-1-carboxamides as analgesic and antiinflammatory agents PFIZER INC. (US) 1985-12-18 — — EP disclosed
US-4556672-A 3-Substituted 2-oxindole-1-carboxamides as analgesic and anti-inflammatory agents PFIZER INC. (US) 1985-12-03 — — US disclosed
EP-0156603-A2 3-Substituted 2-oxindole-1-carboxamides as analgesic and anti-inflammatory agents PFIZER INC. (US) 1985-10-02 — — EP disclosed
EP-0155828-A2 Process for making 2-oxindole-1-carboxamides and intermediates therefor PFIZER INC. (US) 1985-09-25 — — EP disclosed
EP-0153818-A2 1,3-Disubstituted 2-oxindoles as analgesic and anti-inflammatory agents PFIZER INC. (US) 1985-09-04 — — 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-10689396-B2 Inhibitors of Bruton's tyrosine kinase and methods of their use ABL1, BTK, MYLK2 ALDH1A1 3899/4885MAPT 4298/4885LMNA 912/4885
US-10822348-B2 Inhibitors of Bruton's tyrosine kinase and methods of their use ABL1, BTK, MYLK2 ALDH1A1 3899/4885MAPT 4298/4885LMNA 912/4885
US-20230365559-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER DCK, DTYMK, TYMP ALDH1A1 1620/4885MAPT 4128/4885LMNA 1848/4885
US-10800792-B2 Inhibitors of Bruton's tyrosine kinase and method of their use ABL1, BTK, MYLK2 ALDH1A1 4003/4885MAPT 4289/4885LMNA 1091/4885

“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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