SCHEMBL12220586

SCHEMBL12220586

C#CC1(F)C(O)[C@@H](CO)OC1N1C=CC(N)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CDA P32320 8/20 0.37
▸ PDE4D Q08499 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ SLC29A1 Q99808 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
SCHEMBL12194530 1.00 CDA (0.37) CDAPDE4DPDE3ASLC29A1
SCHEMBL15070549 0.84 CDA (0.49) CDAPDE4DPDE3ASLC29A1
SCHEMBL16643735 0.84 CDA (0.49) CDAPDE4DPDE3ASLC29A1
SCHEMBL19866473 0.79 — —
SCHEMBL17742251 0.76 — —
SCHEMBL17737009 0.72 — —
SCHEMBL19535784 0.71 PDE4D (0.48) CDAPDE4DPDE3ASLC29A1
SCHEMBL19536892 0.71 PDE4D (0.48) CDAPDE4DPDE3ASLC29A1
SCHEMBL19535786 0.71 PDE4D (0.48) CDAPDE4DPDE3ASLC29A1
SCHEMBL1375433 0.70 LMNA (0.54) —

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-20110243886-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF VIRAL INFECTIONS SURLERAUX DOMINIQUE 2011-10-06 — — 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-20110243886-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF VIRAL INFECTIONS HAVCR2, PYGL, EIF2AK2 CDA 289/4885PDE4D 1273/4885PDE3A 704/4885

“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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