SCHEMBL7614441

SCHEMBL7614441

CC(c1ccncc1)C(CP(=O)(O)Cc1ccccc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.41
MEN1 O00255 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
ANPEP P15144 1/20 0.40
ERAP2 Q6P179 1/20 0.40
ERAP1 Q9NZ08 1/20 0.40
MMP13 P45452 3/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
MMP3 P08254 2/20 0.38
MMP2 P08253 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
MMP8 P22894 1/20 0.38
MMP12 P39900 1/20 0.38

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
SCHEMBL5134276 0.91 MMP1 (0.44) MMP1MEN1CYP2D6CYP2C9CYP2C19
SCHEMBL5053036 0.86 L3MBTL1 (0.43) ANPEPERAP2ERAP1
SCHEMBL7608381 0.81 ANPEP (0.43) ANPEPERAP2ERAP1SLC6A2SLC6A4
SCHEMBL7613676 0.81 CYP1A2 (0.42) MMP1MEN1CYP2D6CYP2C9CYP2C19
SCHEMBL5051252 0.80 MMP1 (0.39) MMP1MEN1CYP2D6CYP2C9CYP2C19
SCHEMBL7608842 0.80 MEN1 (0.43) MMP1MEN1CYP2D6CYP2C9CYP2C19
SCHEMBL5059745 0.76 GAA (0.46) MEN1CYP2C9CYP2C19KMT2AANPEP
SCHEMBL7614364 0.75 ACP3 (0.49) MMP1
SCHEMBL5057989 0.75 ERAP2 (0.62) ANPEPERAP2ERAP1
SCHEMBL7609685 0.74 MMP1 (0.49) MMP1MEN1CYP2D6CYP2C9CYP2C19

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 MMP1 831/4885MEN1 1872/4885CYP2D6 3737/4885

“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.