SCHEMBL13696202

SCHEMBL13696202

C[C@H]1C[C@@H](CO)O[C@H]1c1ccc2c(=O)[nH]cnn12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALB P02768 1/20 0.33
▸ MAPK1 P28482 1/20 0.33

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
SCHEMBL13532236 0.81 ALDH1A1 (0.33) ALDH1A1LMNA
SCHEMBL20058766 0.76 DOT1L (0.37) —
SCHEMBL13532219 0.76 DOT1L (0.37) —
SCHEMBL13696066 0.76 DOT1L (0.37) —
SCHEMBL12388340 0.73 EGFR (0.31) —
SCHEMBL14642541 0.71 — —
SCHEMBL19412694 0.70 PNP (0.30) —
SCHEMBL881700 0.69 TLR7 (0.40) ALDH1A1LMNAALBMAPK1
SCHEMBL12389151 0.66 LMNA (0.31) LMNA
SCHEMBL14140988 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227524-A1 ANTIVIRAL THERAPEUTIC AGENTS BIOCRYST PHARMACEUTICALS, INC. (US) 2009-09-10 — — 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-20090227524-A1 ANTIVIRAL THERAPEUTIC AGENTS EIF2AK2, ZC3HAV1, MAVS ALDH1A1 2126/4885LMNA 2472/4885ALB 3408/4885

“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.

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