SCHEMBL25050849

SCHEMBL25050849

O=C(CN1CCc2sccc2C1c1ccccc1)C1CCCCCCCCCC1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HHAT Q5VTY9 2/20 0.54
LHCGR P22888 3/20 0.45
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HDAC8 Q9BY41 1/20 0.44
CNR1 P21554 1/20 0.44

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
SCHEMBL24419937 0.95 HHAT (0.55) HHATLHCGRMAPK1NPSR1HDAC8
SCHEMBL23948167 0.94 HHAT (0.56) HHATLHCGRMAPK1NPSR1HDAC8
SCHEMBL24419736 0.93 HHAT (0.55) HHATLHCGRMAPK1NPSR1HDAC8
SCHEMBL23947755 0.85 HHAT (0.45) HHATLHCGRMAPK1NPSR1HDAC8
SCHEMBL25050848 0.82 HDAC8 (0.65) HHATMAPK1NPSR1HDAC8
SCHEMBL25047674 0.78 HDAC8 (0.58) HHATMAPK1NPSR1HDAC8
SCHEMBL23947756 0.76 HDAC8 (0.60) HHATHDAC8
SCHEMBL24419737 0.76 HDAC8 (0.58) HHATHDAC8
SCHEMBL5439863 0.75 HHAT (0.48) HHATLHCGRMAPK1NPSR1
SCHEMBL1499097 0.75 HHAT (0.48) HHATLHCGRMAPK1NPSR1

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-20230047626-A1 SMALL MOLECULE ANTIVIRAL DRUG TREATMENT FOR HUMAN PAPILLOMAVIRUS INFECTIONS THE TRUSTEES OF INDIANA UNIVERSITY 2023-02-16 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-20230047626-A1 SMALL MOLECULE ANTIVIRAL DRUG TREATMENT FOR HUMAN PAPILLOMAVIRUS INFECTIONS TP53, EIF2AK2, POLI HHAT 2179/4885LHCGR 3029/4885MAPK1 3527/4885

“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.