SCHEMBL6525929

SCHEMBL6525929

CCCOCCOC(=O)COC(=O)/C=C/C(=O)OCC(=O)OCCOCCC

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.48
ATM Q13315 1/20 0.47
TSHR P16473 4/20 0.39
ALDH1A1 P00352 3/20 0.39
TP53 P04637 2/20 0.39
HIF1A Q16665 2/20 0.39
HSD17B10 Q99714 1/20 0.39
DGKA P23743 1/20 0.37
MAPT P10636 2/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
THRB P10828 1/20 0.34
NAAA Q02083 1/20 0.33
APP P05067 1/20 0.33
EPHX2 P34913 1/20 0.33
ALOX5 P09917 1/20 0.33
HPGD P15428 1/20 0.32

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
SCHEMBL6515179 0.96 HCAR2 (0.55) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL6518223 0.89 ATM (0.58) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL6517421 0.88 HCAR2 (0.61) HCAR2ATMTSHRALDH1A1DGKA
SCHEMBL6525892 0.88 HCAR2 (0.53) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL6518050 0.87 ALDH1A1 (0.50) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL6514814 0.86 HCAR2 (0.64) HCAR2ATMTSHRALDH1A1DGKA
SCHEMBL6518853 0.86 HCAR2 (0.54) HCAR2ATMDGKAMAPTNPSR1
SCHEMBL5342257 0.86 HCAR2 (0.63) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL15047671 0.86 HCAR2 (0.63) HCAR2ATMTSHRALDH1A1TP53
SCHEMBL6518881 0.84 HCAR2 (0.50) HCAR2ATMTSHRALDH1A1MAPT

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 4559/4885TSHR 3581/4885

“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.