SCHEMBL3516697

SCHEMBL3516697

CNC(=O)c1c(N)c2cccnc2n(O)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 3/20 0.45
EGFR P00533 5/20 0.39
SRC P12931 3/20 0.39
DAO P14920 1/20 0.38
YTHDC1 Q96MU7 1/20 0.37
BRD4 O60885 1/20 0.36
CNR2 P34972 2/20 0.36
CNR1 P21554 1/20 0.36
TP53 P04637 2/20 0.36
PLK1 P53350 1/20 0.35
ELANE P08246 1/20 0.35
POLB P06746 1/20 0.35
PKM P14618 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NLRP3 Q96P20 1/20 0.35

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
SCHEMBL3517675 0.85 CNR2 (0.47) FEN1CNR2CNR1TP53KDM4E
SCHEMBL29588469 0.84 KDM4E (0.45) FEN1EGFRSRCTP53ELANE
SCHEMBL16236415 0.83 FEN1 (0.49) FEN1EGFRSRCDAOELANE
SCHEMBL3517498 0.79 ELANE (0.45) FEN1BRD4ELANEKDM4EALDH1A1
SCHEMBL3517464 0.77 MEN1 (0.39) EGFRSRCCNR2CNR1TP53
SCHEMBL13461636 0.77 MAPT (0.39) CNR2CNR1POLBPKMKDM4E
SCHEMBL16236441 0.77 MET (0.42) CNR1TP53KDM4E
SCHEMBL3514352 0.76 PLK1 (0.50) FEN1BRD4PLK1
SCHEMBL11163601 0.74 KDM4E (0.45) CNR2CNR1POLBPKMKDM4E
SCHEMBL16250051 0.72 FEN1 (0.49) FEN1DAOCNR2CNR1TP53

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 FEN1 115/4885EGFR 4078/4885SRC 4616/4885

“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.