SCHEMBL352337

SCHEMBL352337

O=C(NC1=CC(=O)C2OC2C1O)c1cc2ncoc2cc1O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 1/20 0.46
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NAMPT P43490 2/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL352091 0.80 PARK7 (0.46) PARK7NPC1RAB9ASMN1; SMN2NAMPT
SCHEMBL353426 0.80 PARK7 (0.46) PARK7NPC1RAB9ASMN1; SMN2NAMPT
SCHEMBL665474 0.78 PARK7 (0.49) PARK7NPC1RAB9AMEN1KMT2A
SCHEMBL666087 0.78 PARK7 (0.64) PARK7NPC1RAB9AMEN1ALDH1A1
SCHEMBL167099 0.77 PARK7 (0.50) PARK7NPC1RAB9AMEN1GAA
Dehydroxymethylepoxyquinomicin SCHEMBL14504317 0.74 PARK7 (0.54) PARK7NPC1RAB9ASMN1; SMN2MEN1
Dehydroxymethylepoxyquinomicin SCHEMBL1671089 0.74 PARK7 (0.54) PARK7NPC1RAB9ASMN1; SMN2MEN1
Dehydroxymethylepoxyquinomicin SCHEMBL14491796 0.74 PARK7 (0.54) PARK7NPC1RAB9ASMN1; SMN2MEN1
Dehydroxymethylepoxyquinomicin SCHEMBL1669417 0.74 PARK7 (0.54) PARK7NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL665039 0.74 PARK7 (0.50) PARK7NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411376-B1 INHIBITORS OF NF-KB PROFECTUS BIOSCIENCES INC (US) 2015-04-22 EP claimed
US-8629164-B2 Inhibitors of NF-κB PROFECTUS BIOSCIENCES, INC. (US) 2014-01-14 US claimed
US-20120015952-A1 Inhibitors of NF-KB PROFECTUS BIOSCIENCES, INC. (US) 2012-01-19 US claimed
EP-2411376-B1 INHIBITORS OF NF-KB PROFECTUS BIOSCIENCES INC (US) 2015-04-22 EP disclosed
US-8629164-B2 Inhibitors of NF-κB PROFECTUS BIOSCIENCES, INC. (US) 2014-01-14 US disclosed
EP-2411376-A1 INHIBITORS OF NF-KB Profectus Biosciences, Inc. (US) 2012-02-01 EP disclosed
US-20120015952-A1 Inhibitors of NF-KB PROFECTUS BIOSCIENCES, INC. (US) 2012-01-19 US disclosed
WO-2010111460-A1 INHIBITORS OF NF-KB PROFECTUS BIOSCIENCES, INC. (US) 2010-09-30 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-20120015952-A1 Inhibitors of NF-KB NFKBIA, IKBKB, IKBKG PARK7 3327/4885NPC1 2687/4885RAB9A 2089/4885

“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.