SCHEMBL3525616

SCHEMBL3525616

O=c1c(-c2ccccc2)c(O)c2cc(-c3ccccc3)cnc2n1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 5/20 0.43
RCE1 Q9Y256 1/20 0.43
GSK3B P49841 2/20 0.42
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.39
COMT P21964 1/20 0.37
MAPT P10636 2/20 0.37
CYP1A2 P05177 1/20 0.37
HSD17B10 Q99714 1/20 0.37
DYRK1A Q13627 1/20 0.36
DYRK1B Q9Y463 1/20 0.36
FEN1 P39748 1/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 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
SCHEMBL3516992 0.96 COMT (0.43) KMT2ALMNASMN1; SMN2KDM4ERCE1
SCHEMBL3515769 0.89 FTO (0.40) KMT2ALMNASMN1; SMN2KDM4ERCE1
SCHEMBL13435228 0.86 KDM4E (0.47) KMT2ALMNASMN1; SMN2KDM4ERCE1
SCHEMBL3517548 0.86 KMT2A (0.44) KMT2ALMNASMN1; SMN2KDM4ERCE1
SCHEMBL3515715 0.86 KMT2A (0.42) KMT2ALMNASMN1; SMN2KDM4ERCE1
SCHEMBL3518219 0.86 DPP4 (0.44) KMT2ALMNASMN1; SMN2KDM4ERCE1
SCHEMBL3515126 0.86 AVPR1B (0.40) KMT2ALMNASMN1; SMN2KDM4ERCE1
SCHEMBL3517390 0.83 KDM4E (0.41) KMT2ALMNASMN1; SMN2KDM4ERCE1
SCHEMBL3519936 0.83 IP6K1 (0.41) KMT2ALMNASMN1; SMN2KDM4ERCE1
SCHEMBL3518784 0.83 KMT2A (0.42) KMT2ALMNASMN1; SMN2KDM4ERCE1

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 3 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

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 KMT2A 2764/4885LMNA 658/4885SMN1; SMN2 1566/4885

“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.