SCHEMBL6514907

SCHEMBL6514907

C=C(CC(=O)OC1CCCC1)C(=O)OCC(=O)OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FKBP1A P62942 3/20 0.40
EPHX1 P07099 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP19A1 P11511 2/20 0.39
GAA P10253 1/20 0.38
SGMS2 Q8NHU3 1/20 0.38
CACNA1B Q00975 2/20 0.37

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
SCHEMBL6523546 0.87 TAAR1 (0.41) ALDH1A1EPHX1CYP19A1
SCHEMBL9359405 0.86 ALDH1A1 (0.45) ALDH1A1MAPK1L3MBTL1FKBP1AEPHX1
SCHEMBL6515141 0.86 CYP19A1 (0.44) ALDH1A1MAPK1L3MBTL1MEN1KMT2A
SCHEMBL6520993 0.84 ALDH1A1 (0.40) ALDH1A1L3MBTL1MEN1KMT2ACYP19A1
SCHEMBL6513801 0.83 ALDH1A1 (0.42) ALDH1A1CYP19A1
SCHEMBL6523916 0.83 ALDH1A1 (0.51) ALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL6516328 0.83 MEN1 (0.44) ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL6519870 0.83 ALDH1A1 (0.41) ALDH1A1L3MBTL1EPHX1MEN1KMT2A
SCHEMBL6522170 0.82 ALDH1A1 (0.43) ALDH1A1L3MBTL1MEN1KMT2ACYP19A1
SCHEMBL6515212 0.82 ALDH1A1 (0.43) ALDH1A1L3MBTL1MEN1KMT2ACYP19A1

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.