SCHEMBL13255809

SCHEMBL13255809

CC(=O)CCC(=O)O[C@@H]1C[C@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)O[C@@H]1COP(OCCC#N)N(C(C)C)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.38
P2RY12 Q9H244 6/20 0.35
ADORA1 P30542 2/20 0.34
P2RY1 P47900 2/20 0.34
P2RY2 P41231 1/20 0.34
P2RY6 Q15077 1/20 0.34

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
SCHEMBL23547992 0.88 PRMT6 (0.40) PRMT6P2RY12ADORA1P2RY1P2RY2
SCHEMBL25505318 0.86 PRMT6 (0.39) PRMT6P2RY12ADORA1
SCHEMBL25504694 0.86 ADORA1 (0.41) PRMT6ADORA1
SCHEMBL7206380 0.85 PRMT6 (0.35) PRMT6P2RY12
SCHEMBL21620263 0.84 PRMT6 (0.36) PRMT6P2RY12ADORA1P2RY1P2RY2
SCHEMBL17231772 0.84 P2RY12 (0.37) PRMT6P2RY12P2RY1P2RY2P2RY6
SCHEMBL5482086 0.84 P2RY12 (0.37) PRMT6P2RY12P2RY1P2RY2P2RY6
SCHEMBL5180333 0.84 PRMT6 (0.43) PRMT6P2RY12P2RY1P2RY2P2RY6
SCHEMBL19146295 0.83 PRMT6 (0.38) PRMT6P2RY12
SCHEMBL23547931 0.82 PRMT6 (0.37) PRMT6P2RY12ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7759473-B2 Nucleotide oligomer, nucleotide polymer, method for determining structure of functional substance and method for manufacturing functional substance FUJITSU LIMITED (JP) 2010-07-20 US disclosed
US-20080300393-A1 Nucleotide oligomer, nucleotide polymer, method for determining structure of functional substance and method for manufacturing functional substance FUJITSU LIMITED (JP) 2008-12-04 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 (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-20080300393-A1 Nucleotide oligomer, nucleotide polymer, method for determining structure of functional substance and method for manufacturing functional substance RNMT, NT5C3B, ADAR PRMT6 1332/4885P2RY12 137/4885ADORA1 73/4885

“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.