SCHEMBL3514752

SCHEMBL3514752

CCOC(=O)c1c(O)c2cc(-c3cccc(CN4CCOCC4)c3)cnc2n(O)c1=O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 1/20 0.44
ALDH1A1 P00352 2/20 0.44
TSHR P16473 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
CNR2 P34972 12/20 0.43
CNR1 P21554 3/20 0.42

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
SCHEMBL3518359 0.82 KDM4E (0.48) ALDH1A1TSHRNPSR1LMNAMAPT
SCHEMBL3519310 0.82 KDM4E (0.44) ALDH1A1LMNAMAPT
SCHEMBL3519481 0.81 KDM4E (0.51) ALDH1A1TSHRNPSR1LMNAMAPT
SCHEMBL3517668 0.80 KDM4E (0.48) ALDH1A1NPSR1MAPT
SCHEMBL24002824 0.80 CNR2 (0.61) CNR2CNR1
SCHEMBL3516008 0.78 EGLN1 (0.42) ALDH1A1CNR2
SCHEMBL3514731 0.78 KDM5A (0.43) ALDH1A1LMNAMAPT
SCHEMBL3517888 0.76 ALDH1A1 (0.42) ALDH1A1TSHRLMNA
SCHEMBL25446695 0.76 CNR2 (0.63) CNR2CNR1
SCHEMBL24002680 0.75 CNR2 (0.73) CNR2CNR1

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 4 patents. 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
US-20100056516-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS MERCK SHARP & DOHME CORP. 2010-03-04 US disclosed
US-20100056516-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS MERCK SHARP & DOHME CORP. 2010-03-04 US disclosed
WO-2008010964-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS MERCK & CO., INC. (US) 2008-01-24 WO 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 AVPR1B 1916/4885ALDH1A1 1486/4885TSHR 3624/4885

“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.