SCHEMBL6522375

SCHEMBL6522375

C=C(CC(=O)OCC)C(=O)OCC(=O)OC1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.42
EPHX1 P07099 2/20 0.42
HTT P42858 2/20 0.38
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 3/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
HSD17B10 Q99714 2/20 0.36
ALOX15 P16050 1/20 0.36
NLRP3 Q96P20 1/20 0.36
THRB P10828 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP19A1 P11511 1/20 0.34

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
SCHEMBL6520860 0.94 NAAA (0.42) NAAAEPHX1HTTMGAMGAA
SCHEMBL6521098 0.91 CYP2C19 (0.41) NAAAEPHX1HTTCYP2C19KMT2A
SCHEMBL6523837 0.90 CYP2C19 (0.41) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL6519192 0.90 CYP2C19 (0.41) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL6517224 0.90 NAAA (0.38) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL6524010 0.89 THRB (0.39) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL528947 0.88 NAAA (0.46) NAAAEPHX1HTTMGAMGAA
SCHEMBL6513734 0.88 NAAA (0.39) NAAAEPHX1HTTCYP2C19CYP19A1
SCHEMBL6520319 0.87 NAAA (0.40) NAAAEPHX1HTTCYP2C19ALDH1A1
SCHEMBL6517105 0.87 NAAA (0.48) NAAAEPHX1HTTCYP2C19KMT2A

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 2110/4885EPHX1 558/4885HTT 3273/4885

“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.