SCHEMBL20003769

SCHEMBL20003769

CC(C)C(C)(N)P(=O)(O)OP(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.38
BLM P54132 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GRM4 Q14833 1/20 0.31
LAP3 P28838 1/20 0.30

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
SCHEMBL2510795 0.74 FDPS (0.52) FDPSGRM4LAP3
SCHEMBL12234183 0.71 FDPS (0.50) FDPSBLMTDP1
SCHEMBL21102550 0.68 FDPS (0.41) FDPSBLMTDP1LAP3
Pyrophosphoric Acid SCHEMBL31372313 0.68 FDPS (0.42) FDPSBLMTDP1GRM4LAP3
SCHEMBL21091778 0.67 FDPS (0.31) FDPSBLMTDP1
SCHEMBL14439488 0.67 FDPS (0.45) FDPSBLMTDP1GRM4
Phosphoric Acid SCHEMBL21616464 0.66 FDPS (0.48) FDPSTDP1GRM4LAP3
SCHEMBL10060031 0.66 FDPS (0.50) FDPSBLMTDP1LAP3
SCHEMBL28623681 0.65 LMNA (0.57) FDPSBLMTDP1
Pyrophosphoric Acid SCHEMBL28110229 0.65 FDPS (0.67) FDPSBLMTDP1LAP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180085386-A1 URIDINE MONOPHOSPHATE AND TRIPHOSPHATE DERIVATIVES, COMPOSITIONS AND METHODS OF USE TUFTS UNIVERSITY 2018-03-29 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-20180085386-A1 URIDINE MONOPHOSPHATE AND TRIPHOSPHATE DERIVATIVES, COMPOSITIONS AND METHODS OF USE P2RY6, UPP1, UMPS FDPS 830/4885BLM 877/4885TDP1 99/4885

“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.