SCHEMBL6513738

SCHEMBL6513738

O=C(O)CC(C(=O)O)=C(CC(=O)OC1CCCC1)C1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
NAAA Q02083 2/20 0.37
CYP2C19 P33261 1/20 0.37
EPHX1 P07099 2/20 0.36
CYP19A1 P11511 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CACNA1B Q00975 3/20 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
SCHEMBL6519195 0.98 HTT (0.41) HTTNAAACYP2C19EPHX1CYP19A1
SCHEMBL6523839 0.98 HTT (0.41) HTTNAAACYP2C19EPHX1CYP19A1
SCHEMBL6519507 0.84 EPHX2 (0.35) SMN1; SMN2LMNANPSR1
SCHEMBL6517220 0.82 HTT (0.41) HTTNAAACYP2C19EPHX1CYP19A1
SCHEMBL6521092 0.81 HTT (0.44) HTTNAAACYP2C19EPHX1CYP19A1
SCHEMBL6519704 0.79 HTT (0.47) HTTNAAACYP2C19EPHX1CYP19A1
SCHEMBL6519695 0.79 HTT (0.47) HTTNAAACYP2C19EPHX1CYP19A1
SCHEMBL6520323 0.79 HTT (0.43) HTTNAAACYP2C19EPHX1CYP19A1
SCHEMBL26939170 0.79 NAAA (0.48) HTTNAAACYP2C19EPHX1CYP19A1
SCHEMBL6520868 0.79 ALDH1A1 (0.40) HTTSMN1; SMN2L3MBTL1

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 HTT 3273/4885NAAA 2110/4885CYP2C19 2771/4885

“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.