SCHEMBL6523231

SCHEMBL6523231

CCOC(=O)/C=C/C(=O)OCC(=O)OC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.46
HCAR2 Q8TDS4 1/20 0.44
EPHX1 P07099 1/20 0.42
HTT P42858 2/20 0.42
CYP2C19 P33261 1/20 0.41
LMNA P02545 2/20 0.39
ALDH1A1 P00352 3/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 6/20 0.38
CYP19A1 P11511 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
MDM4 O15151 1/20 0.36
MDM2 Q00987 1/20 0.36

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
SCHEMBL6513399 0.92 CYP2C19 (0.46) NAAAEPHX1HTTCYP2C19LMNA
SCHEMBL7040880 0.90 NAAA (0.43) NAAAEPHX1HTTCYP2C19LMNA
SCHEMBL6519700 0.90 NAAA (0.43) NAAAEPHX1HTTCYP2C19LMNA
SCHEMBL6518782 0.89 KMT2A (0.42) NAAAHCAR2EPHX1HTTCYP2C19
SCHEMBL6516003 0.89 CYP2C19 (0.44) NAAAEPHX1HTTCYP2C19LMNA
SCHEMBL6523609 0.89 CYP2C19 (0.44) NAAAEPHX1HTTCYP2C19LMNA
SCHEMBL9243913 0.87 HCAR2 (0.50) NAAAHCAR2EPHX1HTTCYP2C19
SCHEMBL528354 0.87 HCAR2 (0.50) NAAAHCAR2EPHX1HTTCYP2C19
SCHEMBL528355 0.87 HCAR2 (0.50) NAAAHCAR2EPHX1HTTCYP2C19
SCHEMBL6514416 0.87 NAAA (0.41) NAAAEPHX1HTTCYP2C19LMNA

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 2110/4885HCAR2 3143/4885EPHX1 558/4885

“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.