SCHEMBL16463542

SCHEMBL16463542

CC(N)C(=O)NC(Cc1c[nH]c2ccccc12)C(=O)OC(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.60
CTSL P07711 2/20 0.59
CTSS P25774 1/20 0.59
CTSK P43235 1/20 0.59
MAPT P10636 2/20 0.59
TP53 P04637 1/20 0.59
ACE P12821 3/20 0.57
IL1RN P18510 2/20 0.55
ERAP2 Q6P179 2/20 0.55
ECE1 P42892 4/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL16463539 1.00 TACR1 (0.60) TACR1CTSLCTSSCTSKMAPT
SCHEMBL4842487 0.88 TACR1 (0.56) TACR1CTSLCTSSCTSKMAPT
SCHEMBL30406730 0.88 TACR1 (0.66) TACR1CTSLCTSSCTSKMAPT
SCHEMBL23065018 0.85 ACE (0.60) ACEIL1RNERAP2ECE1
SCHEMBL4068546 0.85 CTSL (0.56) TACR1CTSLCTSSCTSKMAPT
SCHEMBL25453628 0.84 TACR1 (0.58) TACR1CTSLCTSSCTSKMAPT
SCHEMBL8905663 0.84 ECE1 (0.74) ACEIL1RNERAP2ECE1
SCHEMBL23875110 0.84 ECE1 (0.64) ACEECE1
SCHEMBL9235805 0.84 ACE (0.78) ACEECE1
SCHEMBL1228369 0.84 ACE (0.78) ACEECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150274777-A1 KETOAMIDE IMMUNOPROTEASOME INHIBITORS HOFFMANN-LA ROCHE INC. 2015-10-01 US disclosed
EP-2906581-A1 KETOAMIDE IMMUNOPROTEASOME INHIBITORS F. Hoffmann-La Roche AG (CH) 2015-08-19 EP disclosed
CN-104837858-A Ketoamide immunoproteasome inhibitors HOFFMANN LA ROCHE 2015-08-12 CN disclosed
WO-2014056748-A1 KETOAMIDE IMMUNOPROTEASOME INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2014-04-17 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-20150274777-A1 KETOAMIDE IMMUNOPROTEASOME INHIBITORS PSMB7, PSMB5, PSMC2 TACR1 3927/4885CTSL 554/4885CTSS 131/4885

“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.