SCHEMBL1121791

SCHEMBL1121791

O=[N+]([O-])c1c(O)cccc1OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPD P32754 5/20 0.49
HTR1A P08908 1/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48
MAPT P10636 2/20 0.47
GPR35 Q9HC97 1/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PPIA P62937 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MGMT P16455 1/20 0.47
APP P05067 1/20 0.46
ALDH1A1 P00352 1/20 0.45
ALPG P10696 1/20 0.45
PTK2B Q14289 1/20 0.45
CYP19A1 P11511 1/20 0.45

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
SCHEMBL30318898 1.00 HPD (0.49) HPDHTR1AADRA1DADRA1AADRA1B
SCHEMBL15013285 0.89 MAPT (0.55) HPDHTR1AADRA1DADRA1AADRA1B
SCHEMBL29800426 0.85 HPD (0.45) HPDHTR1AADRA1DADRA1AADRA1B
SCHEMBL2986814 0.84 HPD (0.57) HPDPPIAMEN1KMT2AALDH1A1
SCHEMBL9528862 0.83 HTR1A (0.54) HPDHTR1AADRA1DADRA1AADRA1B
SCHEMBL29800323 0.83 PTPN1 (0.44) HPDHTR1AADRA1DADRA1AADRA1B
SCHEMBL6348032 0.82 HPD (0.47) HPDHTR1AMAPTMAPK1TDP1
SCHEMBL2892659 0.82 HPD (0.52) HPDHTR1AADRA1DADRA1AADRA1B
SCHEMBL647866 0.82 TDP1 (0.56) HPDHTR1AADRA1DADRA1AADRA1B
SCHEMBL29617906 0.82 HPD (0.52) HPDHTR1AADRA1DADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12239643-B2 Therapeutic agent for inflammatory diseases, autoimmune diseases, fibrotic diseases, and cancer diseases MEIJI SEIKA PHARMA CO., LTD. (JP) 2025-03-04 US disclosed
US-20230285581-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2023-09-14 US disclosed
US-20230285581-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2023-09-14 US disclosed
US-11666658-B2 Rifamycin analogs and antibody-drug conjugates thereof Regeneran Pharmaceuticals, Inc. (US) 2023-06-06 US disclosed
US-11666658-B2 Rifamycin analogs and antibody-drug conjugates thereof Regeneran Pharmaceuticals, Inc. (US) 2023-06-06 US disclosed
CN-112351986-B Crystals of benzoxazole derivative 明治制果药业株式会社 2023-04-18 CN disclosed
US-11512091-B2 Crystal of benzoxazole derivative MEIJI SEIKA PHARMA CO., LTD. (JP) 2022-11-29 US disclosed
EP-3816167-B1 CRYSTAL OF A BENZOXAZOLE DERIVATIVE MEIJI SEIKA PHARMA CO LTD (JP) 2022-08-03 EP disclosed
CN-110114358-B Novel compound and pharmacologically acceptable salt thereof 明治制果药业株式会社 2021-12-03 CN disclosed
EP-3897841-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF Regeneron Pharmaceuticals, Inc. (US) 2021-10-27 EP disclosed
CN-101253171-A Benzooxazole, oxazolopyridine, benzothiazole and thiazolopyridine derivatives HOFFMANN LA ROCHE (CH) 2008-08-27 CN disclosed
EP-1924579-A2 BENZOOXAZOLE, OXAZOLOPYRIDINE, BENZOTHIAZOLE AND THIAZOLOPYRIDINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-05-28 EP disclosed
US-20070093521-A1 Benzooxazole, oxazolopyridine, benzothiazole and thiazolopyridine derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-04-26 US disclosed
WO-2007025897-A2 BENZOOXAZOLE, OXAZOLOPYRIDINE, BENZOTHIAZOLE AND THIAZOLOPYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-03-08 WO disclosed
EP-1020451-B1 ANILIDE COMPOUNDS AND DRUGS CONTAINING THE SAME KOWA CO (JP) 2005-06-15 EP disclosed
US-6797717-B2 ACYL COENZYME A CHOLESTEROL ACYLTRANSFERASE (ACAT) INHIBITORS KOWA COMPANY, LTD. (JP) 2004-09-28 US disclosed
US-20030087928-A1 Novel anilide compounds and drugs containing the same KOWA COMPANY, LTD., JAPAN 2003-05-08 US disclosed
US-20020099074-A1 Novel anilide compounds and drugs containing the same KOWA COMPANY, LTD.,JAPAN 2002-07-25 US disclosed
US-6362208-B1 ANTICHOLESTEROL AGENT KOWA COMPANY, LTD. (JP) 2002-03-26 US disclosed
EP-1020451-A1 NOVEL ANILIDE COMPOUNDS AND DRUGS CONTAINING THE SAME Kowa Co., Ltd. (JP) 2000-07-19 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 (7 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-20030087928-A1 Novel anilide compounds and drugs containing the same ACAT1, ACAT2, LCAT HPD 1906/4885HTR1A 4606/4885ADRA1D 770/4885
US-20070093521-A1 Benzooxazole, oxazolopyridine, benzothiazole and thiazolopyridine derivatives SSTR5, NPY5R, NPY1R HPD 1200/4885HTR1A 216/4885ADRA1D 111/4885
US-20020099074-A1 Novel anilide compounds and drugs containing the same SOAT1, SOAT2, LCAT HPD 1941/4885HTR1A 3613/4885ADRA1D 253/4885
US-11666658-B2 Rifamycin analogs and antibody-drug conjugates thereof ASGR1, CUTA, SRPRA HPD 4008/4885HTR1A 1849/4885ADRA1D 2018/4885
US-20230285581-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF ASGR1, CUTA, SRPRA HPD 4008/4885HTR1A 1849/4885ADRA1D 2018/4885
US-11512091-B2 Crystal of benzoxazole derivative OXA1L, XDH, CYP4X1 HPD 279/4885HTR1A 1131/4885ADRA1D 1063/4885
US-12239643-B2 Therapeutic agent for inflammatory diseases, autoimmune diseases, fibrotic diseases, and cancer diseases CCR1, SSB, C5 HPD 1830/4885HTR1A 2390/4885ADRA1D 1559/4885

“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.