SCHEMBL3514741

SCHEMBL3514741

O=C(O)Cc1c(O)c2cccnc2n(OCc2ccccc2)c1=O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 17/20 0.49
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL3515858 0.83 MAPT (0.42) KDM4E
SCHEMBL3514876 0.83 CNR2 (0.44) PTGDR2CNR1CNR2MEN1KMT2A
SCHEMBL16238692 0.82 CNR2 (0.46) PTGDR2CNR1CNR2MEN1KMT2A
SCHEMBL3515010 0.81 MAPT (0.41) KDM4E
SCHEMBL3515392 0.81 KDM4E (0.39) CNR1CNR2MEN1KMT2AKDM4E
SCHEMBL1522959 0.80 KDM4E (0.53) CNR1CNR2MEN1KMT2AKDM4E
SCHEMBL3515995 0.80 ALDH1A1 (0.44) CNR1CNR2MEN1KMT2AKDM4E
SCHEMBL3516729 0.79 HIF1A (0.50) CNR1CNR2MEN1KMT2AKDM4E
SCHEMBL3517649 0.77 PTGDR2 (0.48) PTGDR2
SCHEMBL4324294 0.77 ALDH1A1 (0.40) PTGDR2CNR1CNR2MEN1KMT2A

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
EP-2044068-A1 1-HYDROXY NAPHTHYRIDINE COMPOUNDS AS ANTI-HIV AGENTS Merck & Co., Inc. (US) 2009-04-08 EP 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 PTGDR2 4549/4885CNR1 4017/4885CNR2 4813/4885

“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.