SCHEMBL6343233

SCHEMBL6343233

CCCOC(=O)C(N)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.42
LMNA P02545 1/20 0.39
SLC1A2 P43004 4/20 0.36
SLC1A1 P43005 4/20 0.36
SLC1A3 P43003 3/20 0.36
ALDH1A1 P00352 3/20 0.36
GRIK1 P39086 2/20 0.36
GRIK2 Q13002 2/20 0.36
CHRM1 P11229 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
AKR1A1 P14550 1/20 0.36
CHRM3 P20309 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
ADRA1A P35348 1/20 0.36
HRH1 P35367 1/20 0.36
DRD3 P35462 1/20 0.36
SLC6A3 Q01959 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36

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
SCHEMBL12582817 1.00 HCAR2 (0.42) HCAR2LMNASLC1A2SLC1A1SLC1A3
SCHEMBL6343232 0.88 HCAR2 (0.41) HCAR2LMNAALDH1A1CHRM1TDP1
SCHEMBL19990339 0.87 ALDH1A1 (0.50) HCAR2LMNASLC1A2SLC1A1SLC1A3
Butane SCHEMBL9130076 0.86 HCAR2 (0.40) HCAR2LMNAALDH1A1CHRM1TDP1
SCHEMBL8613349 0.85 NAAA (0.48) HCAR2SLC1A2SLC1A1ALDH1A1GRIK1
SCHEMBL28219320 0.82 ALDH1A1 (0.38) HCAR2LMNAALDH1A1CHRM1TDP1
SCHEMBL15083214 0.81 ALOX15 (0.46) HCAR2LMNASLC1A2SLC1A1SLC1A3
SCHEMBL4405650 0.81 ALOX15 (0.46) HCAR2LMNASLC1A2SLC1A1SLC1A3
SCHEMBL12582818 0.81 ALOX15 (0.46) HCAR2LMNASLC1A2SLC1A1SLC1A3
SCHEMBL11878447 0.80 CA1 (0.39) HCAR2LMNAALDH1A1CHRM1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6946554-B2 Process for the preparation of 9-deazaguanine derivatives BIOCRYST PHARMACEUTICALS, INC. (US) 2005-09-20 US disclosed
US-20040254181-A1 Process for the preparation of 9-deazaguanine derivatives BIOCRYST PHARMACEUTICALS, INC. 2004-12-16 US disclosed
EP-0970029-A1 PROCESS FOR THE PREPARATION OF 9-DEAZAGUANINE DERIVATIVES BIOCRYST PHARMACEUTICALS INC. (US) 2000-01-12 EP disclosed
US-5650511-A MULTISTAGE REACTION OF ALDEHYDE OR KETONE WITH NITRILE GROUP TO FORM ENAMINE, REACTION OF ENAMINE WITH BASE TO FORM PYRROLE, THEN REACTION BIOCRYST PHARMACEUTICALS, INC. (US) 1997-07-22 US disclosed
WO-1997021653-A1 PROCESS FOR THE PREPARATION OF 9-DEAZAGUANINE DERIVATIVES BIOCRYST PHARMACEUTICALS, INC. (US) 1997-06-19 WO 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-20040254181-A1 Process for the preparation of 9-deazaguanine derivatives ALKBH3, ALKBH2, ALKBH1 HCAR2 2396/4885LMNA 890/4885SLC1A2 2576/4885

“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.