SCHEMBL6764370

SCHEMBL6764370

CC(C)(C)OC(=O)N/C(=N/C(=O)OCc1ccccc1)n1cccn1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.41
PPARA Q07869 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
CTSL P07711 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
POLB P06746 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
NTSR1 P30989 1/20 0.36
IDO1 P14902 1/20 0.36

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
SCHEMBL6764374 1.00 SYK (0.41) SYKPPARAKMT2AMEN1MAPT
SCHEMBL6764378 0.92 SYK (0.41) SYKPPARAKMT2AMEN1MAPT
SCHEMBL670165 0.89 POLB (0.43) CA12CA1POLB
SCHEMBL670164 0.89 POLB (0.43) CA12CA1POLB
SCHEMBL5567091 0.89 POLB (0.43) CA12CA1POLB
SCHEMBL24177802 0.85 PCSK9 (0.33) KMT2AMEN1
SCHEMBL14271350 0.83 ALDH1A1 (0.40) POLB
SCHEMBL8121 0.83 RAB9A (0.32) L3MBTL1
SCHEMBL13221 0.83 RAB9A (0.32) L3MBTL1
SCHEMBL14135 0.83 RAB9A (0.32) L3MBTL1

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-20040106635-A1 having small-conductance potassium channel (SK) blocking activity TANABE SEIYAKU CO., LTD. (JP) 2004-06-03 US 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-20040106635-A1 having small-conductance potassium channel (SK) blocking activity KCNN1, KCNN2, KCNN3 SYK 2524/4885PPARA 1673/4885KMT2A 1633/4885

“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.