SCHEMBL4641603

SCHEMBL4641603

CN1C[C@H](NC(=O)OC(C)(C)C)[C@@H](NC(=O)OC(C)(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.46
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
BTK Q06187 1/20 0.42
KDM1A O60341 2/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
GAA P10253 2/20 0.41
CYP2C9 P11712 1/20 0.39
HSD11B1 P28845 1/20 0.39
MAOB P27338 2/20 0.38
MAOA P21397 1/20 0.37
EPHX1 P07099 1/20 0.37
EPHX2 P34913 1/20 0.37

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
SCHEMBL4641615 1.00 CTSK (0.46) CTSKNFKB1NFKB2RELABTK
SCHEMBL4641612 1.00 CTSK (0.46) CTSKNFKB1NFKB2RELABTK
SCHEMBL17987961 0.92 CTSK (0.41) CTSKNFKB1NFKB2RELABTK
SCHEMBL14908041 0.91 CTSK (0.43) CTSKNFKB1NFKB2RELABTK
SCHEMBL14908035 0.91 CTSK (0.43) CTSKNFKB1NFKB2RELABTK
SCHEMBL17987960 0.90 CTSK (0.42) CTSKNFKB1NFKB2RELABTK
SCHEMBL24928078 0.88 CTSK (0.41) CTSKNFKB1NFKB2RELABTK
SCHEMBL31368050 0.88 CTSK (0.41) CTSKNFKB1NFKB2RELABTK
SCHEMBL24928082 0.88 CTSK (0.41) CTSKNFKB1NFKB2RELABTK
SCHEMBL14224401 0.85 NFKB1 (0.40) CTSKNFKB1NFKB2RELABTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934924-B1 NOVEL DIAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME KOWA CO (JP) 2008-08-13 EP disclosed
US-6576642-B2 Inhibitors of the production of Ig E antibodies, antiallergens KOWA CO., LTD. (JP) 2003-06-10 US disclosed
US-20010039279-A1 Diamide compounds and compositions containing the same KOWA CO., LTD. (JP) 2001-11-08 US disclosed
US-6297283-B1 EXCELLENT INHIBITORY EFFECT ON THE PRODUCTION OF AN IGE ANTIBODY AND ARE HENCE USEFUL AS ANTIALLERGIC AGENTS KOWA CO., LTD. (JP) 2001-10-02 US disclosed
EP-0934924-A1 NOVEL DIAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME KOWA CO. LTD. (JP) 1999-08-11 EP 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-20010039279-A1 Diamide compounds and compositions containing the same HRH4, HRH2, HRH1 CTSK 1086/4885NFKB1 1807/4885NFKB2 1169/4885

“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.