SCHEMBL3516381

SCHEMBL3516381

CC(CC(=O)O)c1cccc(-c2cccc(-c3cc(=O)n(O)c4ncccc34)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSA P10619 18/20 0.40
GSK3B P49841 1/20 0.38
USP19 O94966 1/20 0.36

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
SCHEMBL3516378 0.81 PLA2G10 (0.43) GSK3B
SCHEMBL3516974 0.78 PDE4A (0.47) GSK3B
SCHEMBL4460861 0.77 FEN1 (0.47)
SCHEMBL3514716 0.76 PRMT5 (0.39)
SCHEMBL3517754 0.75 PIK3CD (0.52)
SCHEMBL3514799 0.75 BRD4 (0.52)
SCHEMBL13435309 0.75 CYP1A2 (0.41)
SCHEMBL3516704 0.75 NR1H2 (0.45) GSK3B
SCHEMBL3515077 0.74 PRKCI (0.41)
SCHEMBL3517807 0.74 ELANE (0.53)

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 CTSA 604/4885GSK3B 1940/4885USP19 1543/4885

“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.