SCHEMBL6523574

SCHEMBL6523574

C=C(C(=O)O)C(CCOC)(CC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTPN1 P18031 2/20 0.38
RAB9A P51151 2/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KYNU Q16719 1/20 0.37
SLC15A1 P46059 1/20 0.36
PTPRC P08575 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 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
SCHEMBL6523907 0.87 ALDH1A1 (0.51) ALDH1A1MAPK1L3MBTL1PTPN1RAB9A
SCHEMBL6523959 0.84 TDP1 (0.35) ALDH1A1L3MBTL1PTPN1RAB9AMAPT
SCHEMBL6518678 0.84 CYP2C9 (0.35) ALDH1A1L3MBTL1MAPTLMNASMN1; SMN2
SCHEMBL6518826 0.82 L3MBTL1 (0.37) ALDH1A1MAPK1L3MBTL1LMNASMN1; SMN2
SCHEMBL6518591 0.82
SCHEMBL6518644 0.81 PTPN1 (0.40) ALDH1A1PTPN1MAPTLMNASMN1; SMN2
SCHEMBL6520503 0.80 MGAM (0.32) ALDH1A1PTPN1SMN1; SMN2TDP1CYP3A4
SCHEMBL6514698 0.80 POLB (0.43) ALDH1A1MAPK1L3MBTL1PTPN1MAPT
SCHEMBL6523700 0.79 TET2 (0.30) KMT2A
SCHEMBL6513718 0.79 TDP1 (0.42) ALDH1A1MAPK1L3MBTL1PTPN1LMNA

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 1254/4885MAPK1 1916/4885L3MBTL1 1615/4885

“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.