SCHEMBL6518902

SCHEMBL6518902

CCC(=O)CC(=C(CC(=O)O)C(=O)O)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.34
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
FFAR3 O14843 1/20 0.32
HSD11B1 P28845 1/20 0.32
EPHX1 P07099 1/20 0.32
TSHR P16473 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 3/20 0.31
HSD17B10 Q99714 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPK1 P28482 1/20 0.31
HPGD P15428 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
SCHEMBL162618 0.88 NAAA (0.37) NAAAHDAC8HDAC6CES2CES1
SCHEMBL6525945 0.83 HAO1 (0.46) NAAATSHRALDH1A1HSD17B10
SCHEMBL6519420 0.81 CES2 (0.35) NAAAHDAC8HDAC6CES2CES1
SCHEMBL6515967 0.81 CES2 (0.35) NAAAHDAC8HDAC6CES2CES1
SCHEMBL6514901 0.81 SMN1; SMN2 (0.33) NAAAHDAC8HDAC6CES2CES1
SCHEMBL16879331 0.81 NAAA (0.33) NAAAHDAC8HDAC6CES2CES1
SCHEMBL6523923 0.81 EPHX2 (0.34) ALDH1A1SMN1; SMN2
SCHEMBL6520868 0.80 ALDH1A1 (0.40) L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL6519783 0.80 HDAC8 (0.32) HDAC8HDAC6CES2CES1EPHX1
SCHEMBL6519507 0.79 EPHX2 (0.35) TSHRHSD17B10SMN1; SMN2

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 NAAA 2110/4885HDAC8 3116/4885HDAC6 2025/4885

“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.