SCHEMBL23085114

SCHEMBL23085114

CCCN1C(=O)C(N)=C(N)NC1O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ GBA1 P04062 1/20 0.30

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
SCHEMBL19505191 0.76 — —
SCHEMBL8435940 0.62 GBA1 (0.47) KDM4EPOLBALOX15ALDH1A1GAA
SCHEMBL6233396 0.61 KDM4E (0.36) KDM4EPOLBALOX15ALDH1A1GAA
SCHEMBL17962638 0.58 KDM4E (0.41) KDM4EPOLBALOX15ALDH1A1GAA
SCHEMBL8724995 0.58 — —
SCHEMBL18927984 0.58 GBA1 (0.39) KDM4EPOLBALOX15ALDH1A1GAA
SCHEMBL5865950 0.57 GAA (0.49) KDM4EALDH1A1GAA
SCHEMBL19014188 0.57 — —
SCHEMBL8560826 0.56 DHFR (0.31) KDM4EALDH1A1GAA
SCHEMBL24684880 0.56 GAA (0.38) KDM4EPOLBALOX15GAAGBA1

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-20210070764-A1 TRICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF IMPETIS BIOSCIENCES LTD. (IN) 2021-03-11 — — 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-20210070764-A1 TRICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF ADORA2A, ADORA3, ADORA1 KDM4E 4494/4885POLB 1649/4885ALOX15 759/4885

“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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