SCHEMBL6100708

SCHEMBL6100708

O=C1c2c(c(O)c3nccnc3c2O)C(=O)N1Cc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 16/20 0.48
FEN1 P39748 1/20 0.40
PIM1 P11309 1/20 0.40

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
SCHEMBL6102056 0.86 KCNN4 (0.51) CHRM5FEN1
SCHEMBL6100789 0.83 CMA1 (0.53) CHRM5
SCHEMBL4150996 0.81 CYP1A2 (0.51)
SCHEMBL6100796 0.81 PTPN1 (0.42) CHRM5FEN1
SCHEMBL5766292 0.80 CA12 (0.41)
SCHEMBL6099606 0.79 GAA (0.41)
SCHEMBL6101383 0.79 CA1 (0.40)
SCHEMBL6102631 0.79 CHRM5 (0.41) CHRM5
SCHEMBL6099694 0.78 CYP1B1 (0.41) FEN1
SCHEMBL5793964 0.76 FAAH (0.49)

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-20060211724-A1 Hiv integrase inhibitors VERSCHUEREN GASTON W 2006-09-21 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-20060211724-A1 Hiv integrase inhibitors SULT1A1, SULT2A1, SULT1E1 CHRM5 782/4885FEN1 531/4885PIM1 1318/4885

“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.