SCHEMBL6506850

SCHEMBL6506850

N=C(NO)c1cccc(-c2ccc(O)c(-c3nc4cc(C(N)=NO)ccc4[nH]3)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
F2 P00734 10/20 0.45
F10 P00742 10/20 0.45
PRSS1 P07477 10/20 0.45
PLG P00747 9/20 0.45
PLAU P00749 9/20 0.45
PLAT P00750 8/20 0.45
HPN P05981 2/20 0.42
PRSS2 P07478 2/20 0.42
PRSS3 P35030 2/20 0.42
HDAC6 Q9UBN7 3/20 0.41
F9 P00740 1/20 0.41
F7 P08709 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
CYP3A4 P08684 1/20 0.40
ADORA2A P29274 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
F3 P13726 1/20 0.38

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
SCHEMBL6510692 0.92 F2 (0.47) F2F10PRSS1PLGPLAU
SCHEMBL6506820 0.91 F2 (0.44) F2F10PRSS1PLGPLAU
SCHEMBL6506693 0.84 HDAC1 (0.48) F2F10PRSS1PLAUHDAC6
SCHEMBL6510661 0.84 F2 (0.46) F2F10PRSS1PLGPLAU
SCHEMBL6510570 0.84 F2 (0.55) F2F10PRSS1PLGPLAU
SCHEMBL5390642 0.83 PLAU (0.57) F2F10PRSS1PLGPLAU
SCHEMBL6505463 0.80 HDAC6 (0.45) F2F10PRSS1PLGPLAU
SCHEMBL6511666 0.80 HDAC6 (0.42) F2F10PRSS1PLGPLAU
SCHEMBL6511681 0.80 HDAC1 (0.44) F2F10PRSS1PLGPLAU
SCHEMBL6510699 0.79 HDAC1 (0.49) F2F10PRSS1PLAUHDAC6

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-20050148646-A1 Dicationic triaryl analogs as anti-protozoan agents BOYKIN DAVID W (US) 2005-07-07 US claimed
US-20050148646-A1 Dicationic triaryl analogs as anti-protozoan agents BOYKIN DAVID W (US) 2005-07-07 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-20050148646-A1 Dicationic triaryl analogs as anti-protozoan agents DDT, DDC, DARS1 F2 2666/4885F10 3872/4885PRSS1 2474/4885

“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.