SCHEMBL3518628

SCHEMBL3518628

NC(=C=O)C(=O)Oc1c(O)c2cccnc2n(Cc2ccc(C(F)(F)F)nc2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 3/20 0.44
CNR2 P34972 6/20 0.40
CNR1 P21554 2/20 0.39
EGLN2 Q96KS0 2/20 0.38
EGLN3 Q9H6Z9 2/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.36
TP53 P04637 1/20 0.36
LMNA P02545 1/20 0.35
HSD17B13 Q7Z5P4 1/20 0.35
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PDE9A O76083 2/20 0.34

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
SCHEMBL4553698 0.81 EGLN1 (0.47) EGLN1CNR2CNR1EGLN2EGLN3
SCHEMBL4553700 0.76 EGLN1 (0.49) EGLN1CNR2CNR1EGLN2EGLN3
SCHEMBL3513806 0.76 EGLN1 (0.51) EGLN1CNR2CNR1EGLN2EGLN3
SCHEMBL3518609 0.75 EGLN1 (0.52) EGLN1CNR2CNR1EGLN2EGLN3
SCHEMBL3514759 0.73 EGLN1 (0.75) EGLN1CNR2CNR1EGLN2EGLN3
SCHEMBL13437408 0.72 EGLN1 (0.61) EGLN1CNR2CNR1EGLN2EGLN3
SCHEMBL3514775 0.71 EGLN1 (0.56) EGLN1CNR2CNR1EGLN2EGLN3
SCHEMBL27793219 0.71 EGLN1 (0.56) EGLN1CNR2CNR1EGLN2EGLN3
SCHEMBL3512344 0.69 TP53 (0.41) EGLN1CNR2CNR1EGLN2EGLN3
SCHEMBL4553615 0.69 EGLN1 (0.75) EGLN1CNR2CNR1EGLN2EGLN3

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-20100056563-A1 NOVEL 1.8-NAPHTHYRIDINE COMPOUNDS 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-20100056563-A1 NOVEL 1.8-NAPHTHYRIDINE COMPOUNDS HIF1AN, HIF1A, EGLN2 EGLN1 5/4885CNR2 2485/4885CNR1 1567/4885

“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.