SCHEMBL5086069

SCHEMBL5086069

CC(C)(C)OC(=O)CC(=O)OC(C)(C)C.CCC(COC)(OCP(=O)(O)O)n1cnc2c(N)ncnc21

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 3/20 0.43
PI4K2B Q8TCG2 3/20 0.43
PI4K2A Q9BTU6 3/20 0.43
PI4KB Q9UBF8 3/20 0.43
CYP3A4 P08684 4/20 0.41
SLC22A6 Q4U2R8 2/20 0.41
FGFR1 P11362 2/20 0.41
ABCB11 O95342 1/20 0.36
POLA1 P09884 1/20 0.36
POLG P54098 1/20 0.36
FAP Q12884 1/20 0.36
ENPP1 P22413 1/20 0.35
CYP2D6 P10635 3/20 0.34
RET P07949 2/20 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
SCHEMBL5082287 0.91 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBCYP3A4
SCHEMBL5086376 0.91 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBCYP3A4
SCHEMBL5083599 0.86 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBCYP3A4
SCHEMBL5086075 0.82 CYP3A4 (0.46) PI4KAPI4K2BPI4K2API4KBCYP3A4
SCHEMBL5080075 0.82 FAP (0.50) PI4KAPI4K2BPI4K2API4KBCYP3A4
SCHEMBL5083667 0.79 P2RY1 (0.33) CYP3A4
SCHEMBL5086450 0.77 DNPH1 (0.38) FGFR1
SCHEMBL5086366 0.76 LMNA (0.36)
SCHEMBL2449991 0.75 PI4KA (0.56) PI4KAPI4K2BPI4K2API4KBCYP3A4
SCHEMBL5086442 0.75 TAS1R3 (0.42) CYP3A4CYP2D6

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-7388002-B2 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2008-06-17 US disclosed
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2006-06-08 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-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases POLR2H, NSUN2, POLR2E PI4KA 2684/4885PI4K2B 1893/4885PI4K2A 2678/4885

“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.