SCHEMBL3514754

SCHEMBL3514754

CN1CCN(c2cc(=O)n(O)c3ncccc23)CC1=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 5/20 0.43
FEN1 P39748 2/20 0.42
LRRK2 Q5S007 7/20 0.37
ATR Q13535 2/20 0.36
ATRIP Q8WXE1 1/20 0.36
PDE10A Q9Y233 1/20 0.34
METAP1 P53582 1/20 0.34
GRIA1 P42261 1/20 0.34

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
SCHEMBL3518929 0.80 FEN1 (0.47) FEN1METAP1
SCHEMBL3516245 0.80 GRIN2D (0.46)
SCHEMBL3514866 0.79 HDAC6 (0.45) FEN1PDE10A
SCHEMBL3517465 0.75 NCF1 (0.50)
SCHEMBL3517901 0.75 NPY2R (0.36) FEN1METAP1
SCHEMBL3519628 0.73 GRM4 (0.39) FEN1ATRATRIP
SCHEMBL3517419 0.73 OPRM1 (0.42)
SCHEMBL3517530 0.73 HDAC6 (0.39)
SCHEMBL3516376 0.73 MAPT (0.42)
SCHEMBL3519168 0.73 GPR142 (0.39)

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-20100056516-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS MERCK SHARP & DOHME CORP. 2010-03-04 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-20100056516-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS RNASEH1, RNASE1, RNASEL PIM1 2103/4885FEN1 115/4885LRRK2 2255/4885

“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.