SCHEMBL6519650

SCHEMBL6519650

CCCOC(=O)CC(CCC)=C(CC(=O)O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 2/20 0.36
FFAR3 O14843 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
DGKA P23743 1/20 0.34
ALDH1A1 P00352 3/20 0.34
FNTA P49354 2/20 0.33
FNTB P49356 2/20 0.33
HCAR2 Q8TDS4 1/20 0.33
FAAH O00519 1/20 0.33
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
PAM P19021 2/20 0.32
LMNA P02545 2/20 0.32
GLA P06280 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL6516722 0.91 HCAR2 (0.36) TOP2ADGKAALDH1A1FNTAFNTB
SCHEMBL6523463 0.91 DGKA (0.34) TOP2AFFAR3HDAC3HDAC1HDAC2
SCHEMBL6513357 0.88 ALDH1A1 (0.33) TOP2ADGKAALDH1A1FNTAFNTB
SCHEMBL6519511 0.84 DGKA (0.34) DGKAFNTAFNTBLMNAL3MBTL1
SCHEMBL6520805 0.84 FAAH (0.41) DGKAALDH1A1FNTAFNTBHCAR2
SCHEMBL6514927 0.82 DGKA (0.33) DGKAALDH1A1FAAHMGAMGAA
SCHEMBL6515512 0.81 FAAH (0.49) DGKAALDH1A1FNTAFNTBFAAH
SCHEMBL6515976 0.81 FAAH (0.44) DGKAALDH1A1HCAR2FAAHPAM
SCHEMBL7118726 0.80 HDAC3 (0.48) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL6514996 0.80 ALDH1A1 (0.41) DGKAALDH1A1FNTAFNTBMGAM

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 TOP2A 1637/4885FFAR3 1434/4885HDAC3 2633/4885

“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.