SCHEMBL6523971

SCHEMBL6523971

C=C(C(=O)O)C(C(=O)O)(C(C)C(=O)OCc1ccccc1)C(C)C(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
ELANE P08246 2/20 0.42
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CTSK P43235 3/20 0.40
SLC15A1 P46059 1/20 0.40
PRTN3 P24158 2/20 0.40
ATM Q13315 1/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CTSB P07858 1/20 0.39
HCAR2 Q8TDS4 1/20 0.39

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
SCHEMBL6523827 0.88 SMN1; SMN2 (0.40) ALDH1A1ELANEL3MBTL1KMT2ALMNA
SCHEMBL6515868 0.80 THRB (0.47) ALDH1A1KMT2ATDP1LMNASMN1; SMN2
SCHEMBL6519676 0.79 ATM (0.45) ALDH1A1ELANEL3MBTL1KMT2ATDP1
SCHEMBL7400523 0.77 ALDH1A1 (0.53) ALDH1A1MAPK1L3MBTL1SLC6A2SLC6A3
SCHEMBL12027690 0.77 ALDH1A1 (0.56) ALDH1A1ELANEMAPK1L3MBTL1SLC6A2
SCHEMBL12137982 0.77 ALDH1A1 (0.56) ALDH1A1ELANEMAPK1L3MBTL1SLC6A2
SCHEMBL6869588 0.77 ALDH1A1 (0.56) ALDH1A1ELANEMAPK1L3MBTL1SLC6A2
SCHEMBL8027537 0.76 ALDH1A1 (0.51) ALDH1A1ELANEMAPK1L3MBTL1SLC6A2
SCHEMBL6870637 0.75 ALDH1A1 (0.55) ALDH1A1ELANEMAPK1L3MBTL1SLC6A2
SCHEMBL6872196 0.75 ALDH1A1 (0.55) ALDH1A1ELANEMAPK1L3MBTL1SLC6A2

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 1254/4885ELANE 185/4885MAPK1 1916/4885

“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.