SCHEMBL4667260

SCHEMBL4667260

CC(=O)C=C1Nc2ccccc2S1.CC(=O)C=C1Nc2ccccc2S1.[Cu]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
GAA P10253 7/20 0.49
NOX1 Q9Y5S8 7/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
ALOX15 P16050 3/20 0.49
SNCA P37840 2/20 0.49
CYBB P04839 1/20 0.49
APP P05067 1/20 0.49
NOX3 Q9HBY0 1/20 0.49
NOX4 Q9NPH5 1/20 0.49
ALDH1A1 P00352 6/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
TGM2 P21980 1/20 0.47
IDO1 P14902 1/20 0.47
TDP1 Q9NUW8 3/20 0.47
CYP1A2 P05177 1/20 0.47
BCHE P06276 1/20 0.47

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
SCHEMBL14403541 0.98 NOX1 (0.50) MAPTGAANOX1MEN1KMT2A
SCHEMBL14079742 0.98 NOX1 (0.50) MAPTGAANOX1MEN1KMT2A
SCHEMBL4665559 0.97 MAPT (0.49) MAPTGAANOX1MEN1KMT2A
SCHEMBL4663453 0.97 MAPT (0.49) MAPTGAANOX1MEN1KMT2A
SCHEMBL12809928 0.84 MAPT (0.52) MAPTGAANOX1MEN1KMT2A
SCHEMBL6691365 0.81 GAA (0.48) MAPTGAANOX1MEN1KMT2A
SCHEMBL14403543 0.81 KDM4E (0.49) MAPTGAANOX1MEN1KMT2A
SCHEMBL14079773 0.79 TGM2 (0.38) MAPTGAANOX1MEN1KMT2A
SCHEMBL9600080 0.79 USP2 (0.51) MAPTGAANOX1MEN1KMT2A
SCHEMBL4663440 0.78 GAA (0.44) MAPTGAANOX1MEN1KMT2A

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-20080193700-A1 Metal Chelates and Their Use in Optical Recording Media Having High Storage Capacity CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2008-08-14 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-20080193700-A1 Metal Chelates and Their Use in Optical Recording Media Having High Storage Capacity TMCO1, KCNN3, CACNA1F MAPT 580/4885GAA 2688/4885NOX1 1041/4885

“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.