SCHEMBL665039

SCHEMBL665039

O=C(NC1=CC(=O)C2OC2C1O)c1ccc(Cl)cc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 1/20 0.50
P2RX1 P51575 6/20 0.45
P2RX4 Q99571 4/20 0.45
P2RX7 Q99572 4/20 0.45
TMPRSS4 Q9NRS4 4/20 0.45
KLKB1 P03952 1/20 0.43
PLAU P00749 2/20 0.42
F2 P00734 1/20 0.42
F10 P00742 1/20 0.42
PLG P00747 1/20 0.42
PLAT P00750 1/20 0.42
KCNMA1 Q12791 2/20 0.40
ALOX15 P16050 1/20 0.40
PNLIP P16233 1/20 0.39
FADS1 O60427 1/20 0.38
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 2/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 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
SCHEMBL666185 0.91 P2RX1 (0.51) PARK7P2RX1P2RX4P2RX7TMPRSS4
SCHEMBL665474 0.88 PARK7 (0.49) PARK7P2RX1P2RX4P2RX7TMPRSS4
SCHEMBL666669 0.88 PARK7 (0.53) PARK7P2RX1P2RX4P2RX7TMPRSS4
SCHEMBL666528 0.86 PARK7 (0.50) PARK7PLAUF2F10PLG
Dehydroxymethylepoxyquinomicin SCHEMBL14504317 0.84 PARK7 (0.54) PARK7P2RX1P2RX4P2RX7KCNMA1
Dehydroxymethylepoxyquinomicin SCHEMBL14491796 0.84 PARK7 (0.54) PARK7P2RX1P2RX4P2RX7KCNMA1
Dehydroxymethylepoxyquinomicin SCHEMBL1669417 0.84 PARK7 (0.54) PARK7P2RX1P2RX4P2RX7KCNMA1
Dehydroxymethylepoxyquinomicin SCHEMBL1671089 0.84 PARK7 (0.54) PARK7P2RX1P2RX4P2RX7KCNMA1
SCHEMBL116427 0.83 PARK7 (0.48) PARK7P2RX1P2RX4P2RX7TMPRSS4
SCHEMBL169409 0.83 PARK7 (0.48) PARK7KLKB1NPC1MAPTRAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046357-A1 Benzamide and Napthamide Derivatives Inhibiting Nuclear Factor-Kappa (B) - (NK-kB) PROFECTUS BIOSCIENCES, INC. (US) 2012-02-23 US claimed
US-20120046357-A1 Benzamide and Napthamide Derivatives Inhibiting Nuclear Factor-Kappa (B) - (NK-kB) PROFECTUS BIOSCIENCES, INC. (US) 2012-02-23 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-20120046357-A1 Benzamide and Napthamide Derivatives Inhibiting Nuclear Factor-Kappa (B) - (NK-kB) NFKBIA, IKBKB, NFKB1 PARK7 3384/4885P2RX1 855/4885P2RX4 1080/4885

“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.