SCHEMBL6523930

SCHEMBL6523930

CCOCCCCCCOC(=O)/C=C/C(=O)OCC(=O)OCCOC

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.45
ATM Q13315 1/20 0.45
NAAA Q02083 1/20 0.37
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.35
CYP3A4 P08684 1/20 0.35
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
APP P05067 3/20 0.33
DGKA P23743 1/20 0.33

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
SCHEMBL6524271 0.91 HCAR2 (0.49) HCAR2ATMNAAAMAPTRAB9A
SCHEMBL6520431 0.87 HCAR2 (0.51) HCAR2ATMNAAAMAPTRAB9A
SCHEMBL6521081 0.84 ATM (0.45) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL6516016 0.84 ATM (0.62) HCAR2ATMNAAAMAPTRAB9A
SCHEMBL6519422 0.83 HCAR2 (0.46) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL6518050 0.83 ALDH1A1 (0.50) HCAR2ATMMAPTALDH1A1TSHR
SCHEMBL6523098 0.83 ATM (0.42) HCAR2ATMMAPTRAB9ANPSR1
SCHEMBL6525827 0.81 ATM (0.52) HCAR2ATMNAAAMAPTRAB9A
SCHEMBL6522493 0.81 ATM (0.59) HCAR2ATMNAAAMAPTRAB9A
SCHEMBL5831138 0.81 ATM (0.65) HCAR2ATMMAPTRAB9ANPSR1

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 HCAR2 3143/4885ATM 4559/4885NAAA 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.