SCHEMBL9159381

SCHEMBL9159381

O=C(O)C1COC2(CCCCC2)O1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
GAA P10253 1/20 0.38
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
HTR1A P08908 2/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1B P35368 1/20 0.33
ALDH1A1 P00352 2/20 0.31
BRD4 O60885 1/20 0.31
ABL1 P00519 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
RIN1 Q13671 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL9162408 1.00 PABPC1 (0.38) PABPC1CTDSP1GAATMEM97SIGMAR1
SCHEMBL9430245 0.84 PABPC1 (0.36) PABPC1CTDSP1GAATMEM97SIGMAR1
SCHEMBL9162801 0.82 PABPC1 (0.35) PABPC1CTDSP1GAA
SCHEMBL9159223 0.82 PABPC1 (0.35) PABPC1CTDSP1GAA
SCHEMBL29392716 0.80 PABPC1 (0.36) PABPC1CTDSP1GAAHTR1AADRA1D
SCHEMBL26054727 0.80 PABPC1 (0.36) PABPC1CTDSP1GAA
SCHEMBL14932765 0.76 PABPC1 (0.36) PABPC1CTDSP1GAATMEM97SIGMAR1
SCHEMBL26598823 0.76 ALDH1A1 (0.47) PABPC1CTDSP1GAASIGMAR1ALDH1A1
SCHEMBL1030223 0.74 HCRTR2 (0.39) TMEM97SIGMAR1
SCHEMBL2038232 0.74 HCRTR2 (0.39) TMEM97SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3389643-B1 NOVEL MURAMYL PEPTIDE DERIVATIVE COMPOUND, SYNTHESIS AND USES THEREOF BHARAT BIOTECH INT LTD (IN) 2023-05-03 EP claimed
US-10576147-B2 Muramyl peptide derivative compound, synthesis and uses thereof BHARAT BIOTECH INTERNATIONAL LIMITED (IN) 2020-03-03 US claimed
US-20180360957-A1 NOVEL MURAMYL PEPTIDE DERIVATIVE COMPOUND, SYNTHESIS AND USES THEREOF BHARAT BIOTECH INTERNATIONAL LIMITED (IN) 2018-12-20 US claimed
EP-3389643-A1 NOVEL MURAMYL PEPTIDE DERIVATIVE COMPOUND, SYNTHESIS AND USES THEREOF Bharat Biotech International Limited (IN) 2018-10-24 EP claimed
WO-2017103944-A1 NOVEL MURAMYL PEPTIDE DERIVATIVE COMPOUND, SYNTHESIS AND USES THEREOF BHARAT BIOTECH INTERNATIONAL LIMITED (IN) 2017-06-22 WO claimed
EP-3389643-B1 NOVEL MURAMYL PEPTIDE DERIVATIVE COMPOUND, SYNTHESIS AND USES THEREOF BHARAT BIOTECH INT LTD (IN) 2023-05-03 EP disclosed
CN-108883080-B Muramyl peptide derivative compounds, their synthesis and use thereof 巴拉特生物技术国际有限公司 2021-12-21 CN disclosed
US-10576147-B2 Muramyl peptide derivative compound, synthesis and uses thereof BHARAT BIOTECH INTERNATIONAL LIMITED (IN) 2020-03-03 US disclosed
US-20180360957-A1 NOVEL MURAMYL PEPTIDE DERIVATIVE COMPOUND, SYNTHESIS AND USES THEREOF BHARAT BIOTECH INTERNATIONAL LIMITED (IN) 2018-12-20 US disclosed
EP-3389643-A1 NOVEL MURAMYL PEPTIDE DERIVATIVE COMPOUND, SYNTHESIS AND USES THEREOF Bharat Biotech International Limited (IN) 2018-10-24 EP disclosed
WO-2017103944-A1 NOVEL MURAMYL PEPTIDE DERIVATIVE COMPOUND, SYNTHESIS AND USES THEREOF BHARAT BIOTECH INTERNATIONAL LIMITED (IN) 2017-06-22 WO disclosed
EP-0426253-B1 Process for the separation of R and S-2,2R1, R2-1,3-dioxolane-4-carboxylic acid SHELL INT RESEARCH (NL) 1995-02-22 EP disclosed
US-5164519-A Process for the separation of R and S-2,2-R1,R2 -1,3-dioxolane-4-carboxylic acid SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 1992-11-17 US disclosed
EP-0426253-A1 Process for the separation of R and S-2,2R1, R2-1,3-dioxolane-4-carboxylic acid SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1991-05-08 EP disclosed
US-RE31512-E SISOMICIN BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1984-01-31 US disclosed
US-4235888-A SISOMYCIN-TYPE ANTIBIOTICS BAYER AKTIENGESELLSCHAFT (DE) 1980-11-25 US 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-20180360957-A1 NOVEL MURAMYL PEPTIDE DERIVATIVE COMPOUND, SYNTHESIS AND USES THEREOF NOD2, HM13, HLA-DRB1 PABPC1 3553/4885CTDSP1 1594/4885GAA 4157/4885
US-10576147-B2 Muramyl peptide derivative compound, synthesis and uses thereof NOD2, HM13, QRFPR PABPC1 3286/4885CTDSP1 1213/4885GAA 4046/4885

“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.