SCHEMBL2932701

SCHEMBL2932701

CC(C)C[CH]NC(=O)[C@@H](NC(=O)c1cncc(-c2cccs2)c1)[C@@H](C)O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCK P08631 6/20 0.39
NR2C2 P49116 6/20 0.39
BTK Q06187 6/20 0.39
EPHA2 P29317 3/20 0.38
XDH P47989 5/20 0.38
CTSB P07858 1/20 0.37
CTSS P25774 1/20 0.37
CAMK2D Q13557 2/20 0.37
GCK P35557 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35

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
SCHEMBL2930310 0.85 CTSA (0.48) XDH
SCHEMBL2932710 0.84 ATM (0.43) HCKNR2C2BTKEPHA2XDH
SCHEMBL2931726 0.83 PSMB5 (0.51) HDAC3HDAC1HDAC2
SCHEMBL2934031 0.81 CTSS (0.42) HCKNR2C2BTKEPHA2CTSB
SCHEMBL606550 0.79 CTSL (0.46) CTSBCTSS
SCHEMBL12190998 0.78 XDH (0.59) HCKNR2C2BTKEPHA2XDH
SCHEMBL2933259 0.78 LMNA (0.50) NPC1RAB9ASMN1; SMN2HDAC1
SCHEMBL2932479 0.77 ELANE (0.50) CAMK2DNPC1RAB9ASMN1; SMN2
SCHEMBL12190988 0.75 XDH (0.44) HCKNR2C2BTKEPHA2XDH
SCHEMBL619140 0.75 HDAC8 (0.45) NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283367-B2 Proteasome inhibitors and methods of using the same CEPHALON, INC. (US) 2012-10-09 US claimed
EP-1846424-B1 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON INC (US) 2010-01-27 EP claimed
US-7468383-B2 Proteasome inhibitors and methods of using the same CEPHALON, INC. (US) 2008-12-23 US claimed
US-20060189806-A1 Proteasome inhibitors and methods of using the same CEPHALON, INC. (US) 2006-08-24 US claimed
US-8283367-B2 Proteasome inhibitors and methods of using the same CEPHALON, INC. (US) 2012-10-09 US disclosed
EP-1846424-B1 PROTEASOME INHIBITORS AND METHODS OF USING THE SAME CEPHALON INC (US) 2010-01-27 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-20060189806-A1 Proteasome inhibitors and methods of using the same PSMB11, PSMB5, PSMB6 HCK 4085/4885NR2C2 3301/4885BTK 1543/4885

“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.