SCHEMBL13622704

SCHEMBL13622704

CC(C)(C)OC(=O)N[C@@H](CN1C(=O)Cc2ccccc2C1=O)C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
APAF1 O14727 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 1/20 0.43
GAA P10253 4/20 0.43
CASP3 P42574 2/20 0.43
SENP8 Q96LD8 2/20 0.43
SENP7 Q9BQF6 2/20 0.43
SENP6 Q9GZR1 2/20 0.43
CASP1 P29466 1/20 0.42
RAB9A P51151 1/20 0.42
BLM P54132 1/20 0.42
CASP7 P55210 1/20 0.42
HSD17B10 Q99714 1/20 0.42
RNASEH1 O60930 1/20 0.39
CASP6 P55212 3/20 0.38
MALT1 Q9UDY8 1/20 0.37
ACHE P22303 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
SCHEMBL13632866 1.00 KMT2A (0.43) KMT2AMEN1APAF1ALDH1A1MAPT
SCHEMBL13622642 0.86 ALDH1A1 (0.43) KMT2AMEN1ALDH1A1MAPTMALT1
SCHEMBL8178666 0.86 ALDH1A1 (0.43) KMT2AMEN1ALDH1A1MAPTMALT1
SCHEMBL8282957 0.86 ALDH1A1 (0.43) KMT2AMEN1ALDH1A1MAPTMALT1
SCHEMBL8282107 0.82 KDM4E (0.44) KMT2AMEN1RAB9AMALT1CTSS
SCHEMBL13622813 0.82 KDM4E (0.44) KMT2AMEN1RAB9AMALT1CTSS
SCHEMBL13622796 0.82 KDM4E (0.44) KMT2AMEN1RAB9AMALT1CTSS
SCHEMBL13632865 0.81 KMT2A (0.55) KMT2AMEN1APAF1ALDH1A1MAPT
SCHEMBL24811437 0.79 APAF1 (0.50) KMT2AMEN1APAF1ALDH1A1MAPT
SCHEMBL24813932 0.75 KMT2A (0.46) KMT2AMEN1APAF1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7619094-B2 Ketoamides with cyclic P4's as inhibitors of NS3 serine protease of hepatitis C virus SCHERING CORPORATION (US) 2009-11-17 US disclosed
US-20070093430-A1 Novel ketoamides with cyclic P4's as inhibitors of NS3 serine protease of hepatitis C virus MERCK SHARP & DOHME CORP. 2007-04-26 US disclosed
US-7173057-B2 Ketoamides with cyclic P4'S as inhibitors of NS3 protease of hepatitis C virus SCHERING CORPORATION (US) 2007-02-06 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-20070093430-A1 Novel ketoamides with cyclic P4's as inhibitors of NS3 serine protease of hepatitis C virus PREP, PRSS1, P4HB KMT2A 1104/4885MEN1 4705/4885APAF1 595/4885

“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.