SCHEMBL4023013

SCHEMBL4023013

CC1N=C(Cc2ccccc2)OC1=O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.37
CALM1 P0DP23 1/20 0.37
SORT1 Q99523 1/20 0.37
MEN1 O00255 1/20 0.35
ELANE P08246 1/20 0.35
KMT2A Q03164 1/20 0.35
PLA2G6 O60733 2/20 0.34
PLA2G4A P47712 1/20 0.34
CTRC Q99895 3/20 0.33
DAO P14920 1/20 0.33
LMNA P02545 1/20 0.33
PDE2A O00408 1/20 0.33

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
SCHEMBL6698320 0.81
SCHEMBL7894644 0.79 MMP9 (0.35) MMP9CALM1SORT1MEN1ELANE
SCHEMBL11125426 0.78 CTRB1 (0.38) MMP9CALM1SORT1MEN1ELANE
SCHEMBL6702045 0.73
SCHEMBL6135974 0.70
SCHEMBL3379728 0.69 USP1 (0.41) MMP9MEN1KMT2A
SCHEMBL6136392 0.68
SCHEMBL15282389 0.68 MMP9 (0.45) MMP9CALM1DAOLMNA
SCHEMBL15282017 0.67 TAAR1 (0.40) MMP9CALM1
SCHEMBL7894646 0.64 HPGD (0.38) CALM1SORT1MEN1ELANEKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8552206-B2 NF-κB inhibitors and uses thereof BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2013-10-08 US disclosed
US-20090275603-A1 NF- kB Inhibitors And Uses Thereof MICHIGAN STATE UNIVERSITY 2009-11-05 US disclosed
EP-1534686-B1 NF-KB INHIBITORS AND USES THEREOF UNIV MICHIGAN STATE (US) 2009-05-20 EP disclosed
US-7528161-B2 NF-kappaB inhibitors and uses thereof MICHIGAN STATE UNIVERSITY (US) 2009-05-05 US disclosed
EP-2034994-A2 NF-KAPPA B INHIBITORS AND USES THEREOF The Board Of Trustees Operating Michigan State University (US) 2009-03-18 EP disclosed
US-20080114015-A1 NF-kB inhibitors and uses thereof BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2008-05-15 US disclosed
US-7345078-B2 NF-κB inhibitors and uses thereof THE BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2008-03-18 US disclosed
WO-2007133790-A2 NF-ϰB INHIBITORS AND USES THEREOF THE BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY (US) 2007-11-22 WO disclosed
US-20050020586-A1 NF-kappaB inhibitors and uses thereof BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2005-01-27 US disclosed
US-20030232998-A1 NF-kB inhibitors and uses threreof BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2003-12-18 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 (4 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-20090275603-A1 NF- kB Inhibitors And Uses Thereof NFKBIA, IKBKB, IKBKG MMP9 3388/4885CALM1 4031/4885SORT1 4697/4885
US-20030232998-A1 NF-kB inhibitors and uses threreof NFKBIA, IKBKB, IKBKG MMP9 4175/4885CALM1 4073/4885SORT1 4392/4885
US-20050020586-A1 NF-kappaB inhibitors and uses thereof NFKBIA, IKBKB, IKBKG MMP9 3918/4885CALM1 4196/4885SORT1 4752/4885
US-20080114015-A1 NF-kB inhibitors and uses thereof NFKBIA, IKBKB, NFKB1 MMP9 2557/4885CALM1 3679/4885SORT1 4827/4885

“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.