SCHEMBL2520307

SCHEMBL2520307

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 2/20 0.56
MMP2 P08253 1/20 0.54
MMP7 P09237 1/20 0.54
MMP9 P14780 1/20 0.54
MMP12 P39900 1/20 0.54
MMP13 P45452 1/20 0.54
MME P08473 2/20 0.53
BACE1 P56817 3/20 0.52
BACE2 Q9Y5Z0 1/20 0.52
ACE P12821 1/20 0.51
GNPAT O15228 1/20 0.51
PSMB5 P28074 1/20 0.51
REN P00797 1/20 0.51

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
SCHEMBL2520304 1.00 NAALAD2 (0.56) NAALAD2MMP2MMP7MMP9MMP12
SCHEMBL29488057 0.92 NAALAD2 (0.65) NAALAD2MMEGNPAT
SCHEMBL31380447 0.92 NAALAD2 (0.65) NAALAD2MMEGNPAT
SCHEMBL30692733 0.92 NAALAD2 (0.65) NAALAD2MMEGNPAT
SCHEMBL5370772 0.90 MME (0.64) MMP2MMP7MMP9MMP12MMP13
SCHEMBL9551455 0.90 MME (0.64) MMP2MMP7MMP9MMP12MMP13
Glycylleucylphenylalanine SCHEMBL4281369 0.90 ACE (0.62) MMP2MMP7MMP9MMP12MMP13
SCHEMBL9829182 0.90 MME (0.64) MMP2MMP7MMP9MMP12MMP13
Glycylleucylphenylalanine SCHEMBL4281374 0.90 ACE (0.62) MMP2MMP7MMP9MMP12MMP13
SCHEMBL2519495 0.89 ACE (0.56) MMP2MMP7MMP9MMP12MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030506-B2 Tumor selective and biodegradable cyclotriphosphazene-platinum(II) conjugate anticancer agent, and preparation method thereof NANOHYBRID CO., LTD (KR) 2011-10-04 US claimed
US-20100249226-A1 TUMOR SELECTIVE AND BIODEGRADABLE CYCLOTRIPHOSPHAZENE-PLATINUM(II) CONJUGATE ANTICANCER AGENT, AND PREPARATION METHOD THEREOF NANOHYBRID CO., LTD (KR) 2010-09-30 US claimed
EP-2137200-A1 TUMOR SELECTIVE AND BIODEGRADABLE CYCLOTRIPHOSPHAZENE-PLATINUM(II) CONJUGATE ANTICANCER AGENT, AND PREPARATION METHOD THEREOF Nanohybrid Co., Ltd. (KR) 2009-12-30 EP claimed
WO-2008130121-A1 TUMOR SELECTIVE AND BIODEGRADABLE CYCLOTRIPHOSPHAZENE-PLATINUM(II) CONJUGATE ANTICANCER AGENT, AND PREPARATION METHOD THEREOF NANOHYBRID CO., LTD. (KR) 2008-10-30 WO 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-20100249226-A1 TUMOR SELECTIVE AND BIODEGRADABLE CYCLOTRIPHOSPHAZENE-PLATINUM(II) CONJUGATE ANTICANCER AGENT, AND PREPARATION METHOD THEREOF PHOSPHO1, TYMP, PAICS NAALAD2 1683/4885MMP2 884/4885MMP7 1764/4885

“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.