SCHEMBL6523978

SCHEMBL6523978

C=C(CC(=O)OC(C)C(=O)OCc1ccccc1)C(=O)OC(C)C(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
CTSK P43235 3/20 0.41
SLC15A1 P46059 1/20 0.41
LMNA P02545 2/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
ATM Q13315 1/20 0.40
CTSB P07858 2/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CTSS P25774 2/20 0.39
CTSL P07711 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
SCHEMBL6523834 0.89 SMN1; SMN2 (0.41) ALDH1A1L3MBTL1MAPK1NPC1RAB9A
SCHEMBL6523874 0.84 TDP1 (0.38) CTSKLMNATSHRSMN1; SMN2KMT2A
SCHEMBL9358970 0.83 TSHR (0.50) ALDH1A1L3MBTL1MAPK1NPC1RAB9A
SCHEMBL396644 0.83 ALDH1A1 (0.53) ALDH1A1L3MBTL1MAPK1NPC1RAB9A
SCHEMBL396643 0.83 ALDH1A1 (0.53) ALDH1A1L3MBTL1MAPK1NPC1RAB9A
SCHEMBL24179030 0.83 ALDH1A1 (0.53) ALDH1A1L3MBTL1MAPK1CTSKSLC15A1
SCHEMBL11887998 0.83 ALDH1A1 (0.53) ALDH1A1L3MBTL1MAPK1CTSKSLC15A1
SCHEMBL6519684 0.82 L3MBTL1 (0.39) ALDH1A1L3MBTL1MAPK1NPC1RAB9A
SCHEMBL6514718 0.81 HCAR2 (0.41) TSHRKMT2A
SCHEMBL21688828 0.81 ALDH1A1 (0.53) ALDH1A1L3MBTL1MAPK1NPC1RAB9A

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 1254/4885L3MBTL1 1615/4885MAPK1 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.