SCHEMBL18844356

SCHEMBL18844356

CSSCO[C@H]1CC(n2ccc(=O)[nH]c2=O)O[C@@H]1COP(=O)(O)O[PH](=O)OP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DUT P33316 2/20 0.47
P2RY2 P41231 13/20 0.44
P2RY4 P51582 9/20 0.44
P2RY6 Q15077 8/20 0.43
P2RY14 Q15391 3/20 0.42

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
SCHEMBL19174701 0.88 P2RY2 (0.59) DUTP2RY2P2RY4P2RY6
SCHEMBL18855474 0.88 P2RY2 (0.59) DUTP2RY2P2RY4P2RY6
SCHEMBL18840555 0.87 TK1 (0.54)
SCHEMBL18844352 0.84 POLB (0.49) P2RY2P2RY4P2RY6
SCHEMBL18840575 0.83 P2RY2 (0.40) P2RY2P2RY4P2RY6
SCHEMBL18844358 0.80 PRMT5 (0.39)
SCHEMBL23734157 0.79 P2RY2 (0.56) DUTP2RY2P2RY4P2RY6P2RY14
SCHEMBL24905837 0.79 P2RY2 (0.56) DUTP2RY2P2RY4P2RY6P2RY14
SCHEMBL18840558 0.76 POLB (0.51) P2RY2
SCHEMBL24023167 0.74 POLB (0.66)

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-20170137869-A1 METHODS FOR SYNTHESIZING NUCLEOTIDE ANALOGUES WITH DISULFIDE LINKERS IsoPlexis Corporation 2017-05-18 US disclosed
US-20170130051-A1 NUCLEOTIDE ANALOGUES IsoPlexis Corporation 2017-05-11 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-20170137869-A1 METHODS FOR SYNTHESIZING NUCLEOTIDE ANALOGUES WITH DISULFIDE LINKERS RNGTT, NT5C3B, DUT DUT 3/4885P2RY2 1196/4885P2RY4 827/4885
US-20170130051-A1 NUCLEOTIDE ANALOGUES NT5C3B, SAMHD1, DUT DUT 3/4885P2RY2 413/4885P2RY4 291/4885

“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.