SCHEMBL6217458

SCHEMBL6217458

CCN(CCN(CCNCC(=O)O)C(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR6 P51684 1/20 0.55
PAX8 Q06710 1/20 0.55
PTGDR2 Q9Y5Y4 6/20 0.42
HTT P42858 1/20 0.42
LTA4H P09960 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
REN P00797 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
TBXA2R P21731 1/20 0.39
PTGIR P43119 1/20 0.39
PTGDR Q13258 1/20 0.39
LMNA P02545 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
SCHEMBL25910825 0.97 CCR6 (0.54) CCR6PAX8PTGDR2HTTLTA4H
SCHEMBL7360571 0.87 CCR6 (0.56) CCR6PAX8PTGDR2ALDH1A1REN
SCHEMBL7366351 0.85 CCR6 (0.53) CCR6PAX8PTGDR2HTTALDH1A1
SCHEMBL17846650 0.83 CCR6 (0.54) CCR6PAX8PTGDR2ALDH1A1KMT2A
SCHEMBL11425197 0.80 CCR6 (0.54) CCR6PAX8PTGDR2HTTALDH1A1
SCHEMBL18594775 0.80 CCR6 (0.52) CCR6PAX8PTGDR2ALDH1A1KMT2A
SCHEMBL31629174 0.79 CCR6 (0.62) CCR6PAX8HTTALDH1A1KMT2A
SCHEMBL16665613 0.79 ALDH1A1 (0.58) CCR6PAX8PTGDR2ALDH1A1KMT2A
SCHEMBL554131 0.78 CCR6 (0.55) CCR6PAX8PTGDR2ALDH1A1KMT2A
SCHEMBL9942494 0.77 CCR6 (0.57) CCR6PAX8PTGDR2ALDH1A1KMT2A

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
EP-1381392-A4 SYNTHETIC CATALYST FOR SELECTIVE CLEAVAGE OF PROTEIN AND METHOD FOR SELECTIVE CLEAVAGE OF PROTEIN USING THE SAME TS CORP (KR) 2005-03-23 EP disclosed
EP-1381392-A1 SYNTHETIC CATALYST FOR SELECTIVE CLEAVAGE OF PROTEIN AND METHOD FOR SELECTIVE CLEAVAGE OF PROTEIN USING THE SAME TS Corporation (KR) 2004-01-21 EP disclosed
US-20020165365-A1 Synthetic catalyst for selective cleavage of protein and method for selective cleavage of protein using the same ARTZYME BIOTECH CORPORATION (KR) 2002-11-07 US disclosed
WO-2002085413-A1 SYNTHETIC CATALYST FOR SELECTIVE CLEAVAGE OF PROTEIN AND METHOD FOR SELECTIVE CLEAVAGE OF PROTEIN USING THE SAME TS CORPORATION (KR) 2002-10-31 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 (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-20020165365-A1 Synthetic catalyst for selective cleavage of protein and method for selective cleavage of protein using the same CPN1, RNPEP, ANPEP CCR6 3245/4885PAX8 4016/4885PTGDR2 4576/4885

“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.