SCHEMBL7614451

SCHEMBL7614451

O=C(O)C(CCc1ccncc1)CP(=O)(O)Cc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ERAP2 Q6P179 3/20 0.60
ERAP1 Q9NZ08 3/20 0.60
ANPEP P15144 2/20 0.60
MMP3 P08254 4/20 0.54
MMP13 P45452 4/20 0.54
MMP2 P08253 4/20 0.54
MMP1 P03956 3/20 0.54
MMP8 P22894 2/20 0.54
MMP12 P39900 2/20 0.54
LAP3 P28838 2/20 0.48

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
SCHEMBL5134279 0.92 MMP13 (0.60) ERAP2ERAP1ANPEPMMP3MMP13
SCHEMBL5053042 0.87 ANPEP (0.61) ERAP2ERAP1ANPEPMMP3MMP13
SCHEMBL5057989 0.86 ERAP2 (0.62) ERAP2ERAP1ANPEPLAP3
SCHEMBL1374357 0.84 GRM3 (0.59)
SCHEMBL7613692 0.82 MMP3 (0.47) MMP3MMP13MMP2MMP1MMP8
SCHEMBL7608852 0.80 MMP13 (0.49) MMP3MMP13MMP2MMP1MMP8
SCHEMBL5051262 0.80 MMP13 (0.49) MMP3MMP13MMP2MMP1MMP8
SCHEMBL5051270 0.79 MMP1 (0.59) MMP3MMP13MMP2MMP1MMP8
SCHEMBL1373664 0.79 GRM3 (0.65)
SCHEMBL7395511 0.79 MMP2 (0.56) ERAP2ERAP1ANPEPMMP3MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151503-A1 Methods of cancer treatment using naaladase inhibitors SLUSHER BARBARA S (US) 2002-10-17 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-20020151503-A1 Methods of cancer treatment using naaladase inhibitors NAALAD2, DNPEP, ACP3 ERAP2 288/4885ERAP1 163/4885ANPEP 5/4885

“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.