SCHEMBL2933644

SCHEMBL2933644

CC(C)C[CH]NC(=O)[C@@H](NC(=O)c1nccc2ccccc12)[C@@H](C)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.49
RAB9A P51151 1/20 0.44
CNR2 P34972 2/20 0.40
HDAC6 Q9UBN7 3/20 0.39
HDAC3 O15379 2/20 0.39
HDAC4 P56524 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC7 Q8WUI4 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC10 Q969S8 2/20 0.39
HDAC11 Q96DB2 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC9 Q9UKV0 2/20 0.39
HDAC5 Q9UQL6 2/20 0.39
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
EGLN1 Q9GZT9 2/20 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
SCHEMBL2933647 0.83 CCR1 (0.49) CCR1RAB9ACNR2HDAC6HDAC3
SCHEMBL8256575 0.81 PSMB5 (0.57) CCR1HDAC6HDAC3HDAC1HDAC2
SCHEMBL2927792 0.81 PSMB5 (0.57) CCR1HDAC6HDAC3HDAC1HDAC2
SCHEMBL2934925 0.80 KDM4E (0.47) RAB9ATP53ELANECTSGCYP3A4
SCHEMBL607370 0.80 NCEH1 (0.41) RAB9AMEN1MAPTKMT2AELANE
SCHEMBL2932636 0.78 EGLN1 (0.41) HDAC3HDAC1HDAC2EGLN1CHRNB2
SCHEMBL15657797 0.78 RAB9A (0.47) CCR1RAB9ACNR2HDAC6HDAC3
SCHEMBL15661683 0.78 RAB9A (0.47) CCR1RAB9ACNR2HDAC6HDAC3
SCHEMBL15657659 0.78 RAB9A (0.47) CCR1RAB9ACNR2HDAC6HDAC3
SCHEMBL15660540 0.78 RAB9A (0.47) CCR1RAB9ACNR2HDAC6HDAC3

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 CCR1 4609/4885RAB9A 3665/4885CNR2 4830/4885

“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.