SCHEMBL6847667

SCHEMBL6847667

CC(Cn1cnc2c(Sc3cccc(O)c3)nc(N)nc21)OCP(=O)(OCC(F)(F)F)OCC(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAP Q12884 2/20 0.40
CYP3A4 P08684 12/20 0.39
CYP1A2 P05177 2/20 0.37
SLC29A1 Q99808 1/20 0.36
HK1 P19367 1/20 0.36
HKDC1 Q2TB90 1/20 0.36
CYP2D6 P10635 9/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
HIF1A Q16665 2/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL6840916 0.91 FAP (0.42) FAPCYP3A4CYP1A2SLC29A1CYP2D6
SCHEMBL6846259 0.87 CYP3A4 (0.52) CYP3A4CYP1A2SLC29A1HK1HKDC1
SCHEMBL6846402 0.86 FAP (0.41) FAPCYP3A4CYP1A2SLC29A1HK1
SCHEMBL6846399 0.86 CYP3A4 (0.40) CYP3A4CYP1A2SLC29A1HK1HKDC1
SCHEMBL13268950 0.85 FAP (0.39) FAPCYP3A4CYP1A2SLC29A1CYP2D6
SCHEMBL6846396 0.85 SLC22A6 (0.39) FAPCYP3A4CYP1A2SLC29A1HK1
SCHEMBL7124772 0.83 CYP1A2 (0.39) CYP3A4CYP1A2SLC29A1HK1HKDC1
SCHEMBL7117963 0.83 CYP1A2 (0.39) CYP3A4CYP1A2SLC29A1HK1HKDC1
SCHEMBL7118739 0.78 CYP3A4 (0.50) CYP3A4CYP1A2SLC29A1HK1HKDC1
SCHEMBL13268948 0.78 CYP3A4 (0.37) FAPCYP3A4CYP1A2SLC29A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6767900-B2 VIRICIDES AGAINST HERPES, HUMAN IMMUNODEFICIENCY, HEPATITIS, CYTOMEGALO AND VARICELLA- ZOSTER VIRUSES MITSUBISHI PHARMA CORPORATION (JP) 2004-07-27 US claimed
US-20030153534-A1 Phosphonate nucleotide compound MITSUBISHI PHARMA CORPORATION (JP) 2003-08-14 US claimed
US-6767900-B2 VIRICIDES AGAINST HERPES, HUMAN IMMUNODEFICIENCY, HEPATITIS, CYTOMEGALO AND VARICELLA- ZOSTER VIRUSES MITSUBISHI PHARMA CORPORATION (JP) 2004-07-27 US disclosed
US-20030153534-A1 Phosphonate nucleotide compound MITSUBISHI PHARMA CORPORATION (JP) 2003-08-14 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-20030153534-A1 Phosphonate nucleotide compound TYMP, PNP, MTAP FAP 633/4885CYP3A4 958/4885CYP1A2 2063/4885

“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.