SCHEMBL13435251

SCHEMBL13435251

Cc1c(O)c2cccnc2n(O)c1=O

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 3/20 0.53
DAO P14920 1/20 0.41
SLC6A2 P23975 1/20 0.40
HTT P42858 1/20 0.40
HPGD P15428 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPC1 O15118 1/20 0.39
HSP90AA1 P07900 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
COMT P21964 1/20 0.36
MAPT P10636 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
SCHEMBL13402676 0.84 FEN1 (0.56) FEN1SLC6A2HTTHPGDCYP1A2
SCHEMBL13402864 0.83 FEN1 (0.44) FEN1SLC6A2HTTHPGDCYP1A2
SCHEMBL3518030 0.80 FEN1 (0.49) FEN1HTTHPGDNPC1ALDH1A1
SCHEMBL10412161 0.79 FEN1 (0.58) FEN1CYP2C19ALDH1A1NPSR1
SCHEMBL13461600 0.78 FEN1 (0.47) FEN1DAOHPGDNPC1HSP90AA1
SCHEMBL13435249 0.77 FEN1 (0.46) FEN1DAOHTTCYP1A2NPC1
SCHEMBL16250051 0.77 FEN1 (0.49) FEN1DAOHPGDNPC1ALDH1A1
SCHEMBL3514828 0.77 FEN1 (0.46) FEN1HPGDNPC1ALDH1A1KDM4E
SCHEMBL3517675 0.77 CNR2 (0.47) FEN1HTTHPGDNPC1ALDH1A1
SCHEMBL3514525 0.77 ALDH1A1 (0.55) HTTHPGDALDH1A1KDM4E

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 FEN1 115/4885DAO 3247/4885SLC6A2 2805/4885

“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.