SCHEMBL5542946

SCHEMBL5542946

O=CNc1ccccc1N1CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
ALDH1A1 P00352 5/20 0.52
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.52
CYP2C19 P33261 2/20 0.52
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
DDB1 Q16531 1/20 0.51
CRBN Q96SW2 1/20 0.51
TSHR P16473 3/20 0.50
KCNQ2 O43526 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
EPHX2 P34913 1/20 0.49
HPGD P15428 1/20 0.49
MAPK10 P53779 1/20 0.49
NPC1 O15118 1/20 0.48
POLB P06746 2/20 0.48
MCOLN3 Q8TDD5 1/20 0.48
SCN9A Q15858 1/20 0.48

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
SCHEMBL4468998 0.80 ADRB1 (0.51) LMNAALDH1A1CYP1A2CYP2C19TSHR
SCHEMBL5543471 0.80 MAPK1 (0.51) LMNAALDH1A1KMT2AMEN1TSHR
SCHEMBL11666677 0.77 ALDH1A1 (0.52) ALDH1A1CYP1A2CYP3A4CYP2C19KMT2A
SCHEMBL11666671 0.77 ALDH1A1 (0.52) ALDH1A1CYP1A2CYP3A4CYP2C19KMT2A
SCHEMBL8342797 0.77 ALDH1A1 (0.55) LMNAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL6228918 0.77 ALDH1A1 (0.52) LMNAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL9424371 0.77 ALDH1A1 (0.49) LMNAALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL5542939 0.77 ALDH1A1 (0.52) ALDH1A1CYP1A2CYP3A4CYP2C19KMT2A
SCHEMBL20910885 0.77 ALDH1A1 (0.68) ALDH1A1CYP1A2CYP3A4CYP2C19KMT2A
Hydrochloric Acid SCHEMBL5339525 0.76 ALDH1A1 (0.51) ALDH1A1CYP1A2CYP3A4CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119173603-A Composition for adhesive, hot melt adhesive composition, and adhesive 日本瑞翁株式会社 2024-12-20 CN disclosed
CN-113288817-B Dental materials based on cyclizable polymeric crosslinkers 义获嘉伟瓦登特公司 2024-06-14 CN disclosed
CN-116940647-A Curable adhesive composition comprising maleimide and thiol 汉高股份有限及两合公司 2023-10-24 CN disclosed
CN-114729156-A Shaped dielectric component crosslinked by irradiation and method of making same 罗杰斯公司 2022-07-08 CN disclosed
EP-3861976-B1 DENTAL MATERIALS BASED ON CYCLOPOLYMERISABLE CROSS-LINKING AGENTS IVOCLAR VIVADENT AG (LI) 2022-03-30 EP disclosed
CN-110072686-B Flexographic platemaking machine and method for making flexographic plate 爱克发有限公司 2021-09-28 CN disclosed
EP-3861976-A1 DENTAL MATERIALS BASED ON CYCLOPOLYMERISABLE CROSS-LINKING AGENTS Ivoclar Vivadent AG (LI) 2021-08-11 EP disclosed
CN-108698398-B Customizable printing plate and method of making same 麦克德米德图像方案股份有限公司 2020-09-15 CN disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 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 (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-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 LMNA 4152/4885ALDH1A1 355/4885CYP1A2 659/4885

“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.