SCHEMBL6520571

SCHEMBL6520571

C=C(C(=O)O)C(CC(=O)OCCCOC)(CC(=O)OCCCOC)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.31
ARG1 P05089 1/20 0.31
ARG2 P78540 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL6520770 0.90 TSHR (0.32)
SCHEMBL6515982 0.86 NAAA (0.41) ALDH1A1TDP1MEN1KMT2A
SCHEMBL6514774 0.83 NAAA (0.50) ALDH1A1
SCHEMBL6518591 0.83
SCHEMBL6516728 0.82 ALDH1A1 (0.37) ALDH1A1
SCHEMBL6517076 0.82 CYP3A4 (0.36) ALDH1A1TDP1
SCHEMBL6520799 0.79 NAAA (0.38) ALDH1A1TDP1MEN1KMT2A
SCHEMBL6520503 0.79 MGAM (0.32) ALDH1A1TDP1
SCHEMBL6514741 0.78 GAA (0.40) ALDH1A1
SCHEMBL6525875 0.78 THRB (0.45) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed
US-20030118544-A1 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-06-26 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-20030118544-A1 Antifouling coating composition and novel resin COL1A1, GLRA1, COL2A1 ALDH1A1 1254/4885TDP1 1789/4885ARG1 367/4885

“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.