SCHEMBL7130409

SCHEMBL7130409

CCCCOc1cccc(Sc2nc(N)nc3c2ncn3CC(C)OCP(=O)(O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 12/20 0.47
CYP2D6 P10635 10/20 0.44
SLC29A1 Q99808 1/20 0.41
PNP P00491 1/20 0.39
CYP1A2 P05177 1/20 0.38
HPRT1 P00492 1/20 0.37
HK1 P19367 1/20 0.37
HKDC1 Q2TB90 1/20 0.37

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
SCHEMBL7127153 0.96 CYP3A4 (0.48) CYP3A4CYP2D6SLC29A1PNPCYP1A2
SCHEMBL7121168 0.93 CYP3A4 (0.49) CYP3A4CYP2D6SLC29A1PNPCYP1A2
SCHEMBL7131157 0.91 CYP3A4 (0.51) CYP3A4CYP2D6SLC29A1HPRT1
SCHEMBL7127111 0.91 CYP3A4 (0.49) CYP3A4CYP2D6SLC29A1PNPCYP1A2
SCHEMBL7118739 0.90 CYP3A4 (0.50) CYP3A4CYP2D6SLC29A1PNPCYP1A2
SCHEMBL7127145 0.90 CYP3A4 (0.49) CYP3A4CYP2D6SLC29A1PNPCYP1A2
SCHEMBL7122259 0.88 CYP3A4 (0.51) CYP3A4CYP2D6SLC29A1CYP1A2HPRT1
SCHEMBL7773535 0.88 SLC29A1 (0.44) CYP3A4CYP2D6SLC29A1CYP1A2HK1
SCHEMBL6846259 0.87 CYP3A4 (0.52) CYP3A4CYP2D6SLC29A1PNPCYP1A2
SCHEMBL7125887 0.86 FGFR1 (0.45) CYP3A4CYP2D6SLC29A1PNPCYP1A2

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-20030109498-A1 Antiviral agent for drug-resistant virus MITSUBISHI PHARMA CORPORATION (JP) 2003-06-12 US claimed
US-20030109498-A1 Antiviral agent for drug-resistant virus MITSUBISHI PHARMA CORPORATION (JP) 2003-06-12 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-20030109498-A1 Antiviral agent for drug-resistant virus TPMT, MTAP, TYMP CYP3A4 977/4885CYP2D6 142/4885SLC29A1 5/4885

“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.