SCHEMBL2278384

SCHEMBL2278384

CC(C)(C)OC[C@H](NCc1cccc(B(O)O)c1)C(=O)OC1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 10/20 0.42
MAPK14 Q16539 1/20 0.42
CACNA1B Q00975 5/20 0.40
EPHX1 P07099 1/20 0.39
PSMB8 P28062 5/20 0.37
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL2281258 0.85 EPHX1 (0.41) PSMB5MAPK14EPHX1PSMB8
SCHEMBL2281260 0.85 EPHX1 (0.41) PSMB5MAPK14EPHX1PSMB8
SCHEMBL12374502 0.83 PSMB5 (0.41) PSMB5CACNA1BEPHX1PSMB8MEN1
SCHEMBL2283112 0.83 PSMB5 (0.41) PSMB5CACNA1BEPHX1PSMB8MEN1
SCHEMBL2283105 0.83 PSMB5 (0.41) PSMB5CACNA1BEPHX1PSMB8MEN1
SCHEMBL1147395 0.82 EPHX1 (0.44) PSMB5EPHX1PSMB8MEN1KMT2A
SCHEMBL1411201 0.81 TPSAB1 (0.46) MAPK14CACNA1BALDH1A1
SCHEMBL2282080 0.81 EPHX1 (0.43) PSMB5MAPK14CACNA1BEPHX1PSMB8
SCHEMBL2286208 0.79 EPHX1 (0.47) PSMB5EPHX1PSMB8ALDH1A1MEN1
SCHEMBL1491533 0.78 HDAC1 (0.47) MAPK14

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-2078007-B1 IKK-BETA SERINE-THREONINE PROTEIN KINASE INHIBITORS CHROMA THERAPEUTICS LTD (GB) 2011-08-31 EP disclosed
EP-2078007-B1 IKK-BETA SERINE-THREONINE PROTEIN KINASE INHIBITORS CHROMA THERAPEUTICS LTD (GB) 2011-08-31 EP disclosed
US-8003695-B2 IKK-beta serine-threonine protein kinase inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-08-23 US disclosed
US-8003695-B2 IKK-beta serine-threonine protein kinase inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-08-23 US disclosed
US-8003695-B2 IKK-beta serine-threonine protein kinase inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-08-23 US disclosed
US-20100087515-A1 IKK-BETA SERINE-THREONINE PROTEIN KINASE INHIBITORS Chroma Terapeutics Ltd (GB) 2010-04-08 US disclosed
US-20100087515-A1 IKK-BETA SERINE-THREONINE PROTEIN KINASE INHIBITORS Chroma Terapeutics Ltd (GB) 2010-04-08 US disclosed
US-20100087515-A1 IKK-BETA SERINE-THREONINE PROTEIN KINASE INHIBITORS Chroma Terapeutics Ltd (GB) 2010-04-08 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-20100087515-A1 IKK-BETA SERINE-THREONINE PROTEIN KINASE INHIBITORS IRAK3, IKBKE, IRAK1 PSMB5 580/4885MAPK14 654/4885CACNA1B 2269/4885

“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.