SCHEMBL5576835

SCHEMBL5576835

CC(NC(=O)OCc1ccccc1)C(=O)NC(CCCNC(=N)N)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CPB1 P15086 1/20 0.54
CPB2 Q96IY4 1/20 0.54
FOLH1 Q04609 2/20 0.53
SIRT2 Q8IXJ6 2/20 0.52
SIRT1 Q96EB6 1/20 0.52
ITGB3 P05106 2/20 0.50
ITGAV P06756 2/20 0.50
CAPN1 P07384 1/20 0.49
CAPN2 P17655 1/20 0.49
CTSK P43235 1/20 0.49
CTSL P07711 2/20 0.48
CTSS P25774 1/20 0.48
TGM2 P21980 1/20 0.48
ECE1 P42892 2/20 0.47
MME P08473 1/20 0.47
PTGER4 P35408 1/20 0.47
PSMB8 P28062 1/20 0.47
PSMB9 P28065 1/20 0.47
PSMB5 P28074 1/20 0.47

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
SCHEMBL31689766 1.00 CPB1 (0.54) CPB1CPB2FOLH1SIRT2SIRT1
SCHEMBL5576838 1.00 CPB1 (0.54) CPB1CPB2FOLH1SIRT2SIRT1
SCHEMBL3793063 0.98 CPB1 (0.54) CPB1CPB2FOLH1SIRT2SIRT1
SCHEMBL3793060 0.98 CPB1 (0.54) CPB1CPB2FOLH1SIRT2SIRT1
SCHEMBL8595664 0.95 CTSL (0.56) CPB1CPB2CAPN1CTSKCTSL
SCHEMBL11411256 0.91 CTSL (0.56) CPB1CPB2FOLH1SIRT2SIRT1
SCHEMBL6768020 0.90 FOLH1 (0.59) CPB1CPB2FOLH1SIRT2SIRT1
SCHEMBL5145708 0.90 FOLH1 (0.59) CPB1CPB2FOLH1SIRT2SIRT1
SCHEMBL631840 0.90 FOLH1 (0.59) CPB1CPB2FOLH1SIRT2SIRT1
SCHEMBL24525682 0.90 CPB1 (0.52) CPB1CPB2FOLH1SIRT2SIRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7223837-B2 Anticancer prodrugs, enhance enzymatic activation rates SYNTARGA B.V. (NL) 2007-05-29 US claimed
US-20040121940-A1 Elongated and multiple spacers in activatible produgs BYONDIS B.V. (NL) 2004-06-24 US claimed

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-20040121940-A1 Elongated and multiple spacers in activatible produgs PLG, KLK1, PKM CPB1 385/4885CPB2 602/4885FOLH1 77/4885

“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.