SCHEMBL4600611

SCHEMBL4600611

COc1ccc(CNC(=O)NC(CCCCN)C(=O)O)cc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 3/20 0.69
ANPEP P15144 1/20 0.56
KMT2A Q03164 2/20 0.54
CASR P41180 1/20 0.51
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
ATM Q13315 2/20 0.48
FOLH1 Q04609 1/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
ITGB3 P05106 1/20 0.46
ITGA2B P08514 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
FPR2 P25090 1/20 0.46
CPB1 P15086 1/20 0.46

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
SCHEMBL4600604 1.00 CPB2 (0.69) CPB2ANPEPKMT2ACASRNPC1
SCHEMBL4599998 0.86 CPB2 (0.53) CPB2ANPEPKMT2ANPC1RAB9A
SCHEMBL4600004 0.86 CPB2 (0.53) CPB2ANPEPKMT2ANPC1RAB9A
SCHEMBL11207354 0.85 ALDH1A1 (0.56) CPB2ANPEPATMFOLH1ALDH1A1
SCHEMBL8853611 0.85 ALDH1A1 (0.56) CPB2ANPEPATMFOLH1ALDH1A1
SCHEMBL13559300 0.84 ANPEP (0.59) CPB2ANPEPKMT2ACASRNPC1
SCHEMBL4599368 0.84 CPB2 (0.67) CPB2KMT2AFOLH1ALDH1A1LMNA
SCHEMBL4599358 0.84 CPB2 (0.67) CPB2KMT2AFOLH1ALDH1A1LMNA
SCHEMBL4599834 0.84 CPB2 (0.67) CPB2KMT2AFOLH1ALDH1A1LMNA
SCHEMBL4600264 0.84 CPB2 (0.56) CPB2KMT2ANPC1ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-17 US disclosed
WO-2008080223-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-10 WO disclosed
EP-1910279-A2 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2008-04-16 EP disclosed
US-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-25 US disclosed
WO-2007002639-A2 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-04 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 (2 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-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF HAVCR2, ADAR, NSUN2 CPB2 1198/4885ANPEP 44/4885KMT2A 3406/4885
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE POLQ, POLI, POLH CPB2 1322/4885ANPEP 1315/4885KMT2A 1805/4885

“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.