SCHEMBL177344

SCHEMBL177344

Nc1ccccc1COC=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.38
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SRC P12931 1/20 0.35
AR P10275 1/20 0.33
ALDH1A1 P00352 4/20 0.33
HSD17B10 Q99714 2/20 0.33
TSHR P16473 1/20 0.33
IDO1 P14902 7/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11406620 0.84 SRC (0.40) SMN1; SMN2SRCALDH1A1IDO1MEN1
SCHEMBL5539864 0.80 FDPS (0.36) FDPSCYP3A4ALOX15CASP1CASP7
Ethoxycarbonyl Group SCHEMBL28870102 0.80 ALDH1A1 (0.42) FDPSCYP3A4ALOX15CASP1CASP7
SCHEMBL27671951 0.79 KDM4E (0.49) SMN1; SMN2SRCIDO1
SCHEMBL11809567 0.79 ALDH1A1 (0.37) FDPSCYP3A4ALOX15CASP1CASP7
Propylformate SCHEMBL28281240 0.77 CYP1A2 (0.41) FDPSALDH1A1HSD17B10MEN1KMT2A
SCHEMBL5984182 0.77 SRC (0.42) SRCIDO1L3MBTL1
SCHEMBL133172 0.75 CDK4 (0.50) SRCALDH1A1TSHRKMT2A
SCHEMBL28924 0.75 IDO1 (0.55) SMN1; SMN2ALDH1A1HSD17B10TSHRIDO1
SCHEMBL98043 0.75 IDO1 (0.55) ALDH1A1IDO1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116806157-A Linker-payload and conjugates thereof 芬兰吉利科斯有限公司 2023-09-26 CN claimed
CN-111065416-A Hydrophilic linkers and conjugates thereof 芬兰吉利科斯有限公司 2020-04-24 CN claimed
EP-4267188-A1 COMPOUNDS COMPRISING A TETRAPEPTIDIC MOIETY Cobiores NV (BE) 2023-11-01 EP disclosed
CN-116806157-A Linker-payload and conjugates thereof 芬兰吉利科斯有限公司 2023-09-26 CN disclosed
CN-116635054-A Compounds comprising tetrapeptide moieties 科比欧尔斯公司 2023-08-22 CN disclosed
WO-2022167664-A1 COMPOUNDS COMPRISING A TETRAPEPTIDIC MOIETY COBIORES NV (BE) 2022-08-11 WO disclosed
WO-2022136586-A1 COMPOUNDS COMPRISING A TETRAPEPTIDIC MOIETY COBIORES NV (BE) 2022-06-30 WO disclosed
CN-106749665-B Conjugates of CC-1065 analogs and bifunctional linkers 辛塔佳有限公司 2021-03-26 CN disclosed
CN-111065416-A Hydrophilic linkers and conjugates thereof 芬兰吉利科斯有限公司 2020-04-24 CN disclosed
EP-2405944-B1 PRODRUGS KTB TUMORFORSCHUNGS GMBH (DE) 2016-01-27 EP disclosed
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
US-8642555-B2 Prodrugs KTB TUMORFORSCHUNGSGESELLSCHAFT MBH (DE) 2014-02-04 US 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-20120094892-A1 PRODRUGS KTB TUMORFORSCHUNGSGESELLSCHAFT MBH (DE) 2012-04-19 US disclosed
EP-2405944-A1 PRODRUGS KTB Tumorforschungsgesellschaft mbH (DE) 2012-01-18 EP disclosed
WO-2010102788-A1 PRODRUGS KTB TUMORFORSCHUNGSGESELLSCHAFT MBH (DE) 2010-09-16 WO 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 (2 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 FDPS 1781/4885CYP3A4 1683/4885ALOX15 2847/4885
US-20120094892-A1 PRODRUGS ACP3, KLK3, FOLH1 FDPS 261/4885CYP3A4 646/4885ALOX15 3066/4885

“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.