SCHEMBL6522211

SCHEMBL6522211

C=C(CC(=O)OCCCC)C(=O)OCC(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.41
TSHR P16473 3/20 0.41
NAAA Q02083 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
ATM Q13315 1/20 0.38
DGKA P23743 1/20 0.37
NPSR1 Q6W5P4 2/20 0.36
RAD52 P43351 1/20 0.36
EPHX1 P07099 1/20 0.35
PPARD Q03181 1/20 0.35
LMNA P02545 1/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
NCOA1 Q15788 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
ACHE P22303 2/20 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
SCHEMBL6518799 0.94 TSHR (0.41) FAAHTSHRNAAAALDH1A1HPGD
SCHEMBL6520802 0.93 FAAH (0.44) FAAHTSHRNAAAALDH1A1HPGD
SCHEMBL6515980 0.92 FAAH (0.42) FAAHTSHRNAAAALDH1A1HPGD
SCHEMBL194857 0.88 TSHR (0.52) FAAHTSHRNAAAALDH1A1HPGD
SCHEMBL6515504 0.87 NAAA (0.53) FAAHTSHRNAAADGKANPSR1
SCHEMBL29221851 0.87 TSHR (0.45) FAAHTSHRNAAAALDH1A1HPGD
SCHEMBL28132099 0.86 TSHR (0.50) FAAHTSHRNAAAALDH1A1HPGD
Hydrochloric Acid SCHEMBL10881989 0.86 TSHR (0.50) FAAHTSHRNAAAALDH1A1HPGD
SCHEMBL10057778 0.86 TSHR (0.50) FAAHTSHRNAAAALDH1A1HPGD
SCHEMBL6657456 0.86 FAAH (0.46) FAAHTSHRNAAAALDH1A1HPGD

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 FAAH 920/4885TSHR 3581/4885NAAA 2110/4885

“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.