SCHEMBL6525892

SCHEMBL6525892

CCCOC(=O)COC(=O)/C=C/C(=O)OCCOCC

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.53
ATM Q13315 1/20 0.47
ALDH1A1 P00352 4/20 0.44
TSHR P16473 3/20 0.44
THRB P10828 2/20 0.40
MAPT P10636 4/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
APP P05067 1/20 0.37
ALOX5 P09917 1/20 0.36
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 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
SCHEMBL6518050 0.93 ALDH1A1 (0.50) HCAR2ATMALDH1A1TSHRTHRB
SCHEMBL6515179 0.92 HCAR2 (0.55) HCAR2ATMALDH1A1TSHRTHRB
SCHEMBL6516016 0.90 ATM (0.62) HCAR2ATMALDH1A1TSHRTHRB
SCHEMBL6518881 0.90 HCAR2 (0.50) HCAR2ATMALDH1A1TSHRTHRB
SCHEMBL6519880 0.90 ALDH1A1 (0.47) HCAR2ATMALDH1A1TSHRTHRB
SCHEMBL6514814 0.89 HCAR2 (0.64) HCAR2ATMALDH1A1TSHRMAPT
SCHEMBL6525929 0.88 HCAR2 (0.48) HCAR2ATMALDH1A1TSHRTHRB
SCHEMBL6517421 0.88 HCAR2 (0.61) HCAR2ATMALDH1A1TSHRMAPT
SCHEMBL2898088 0.84 ALDH1A1 (0.60) HCAR2ATMALDH1A1TSHRTHRB
SCHEMBL2897724 0.84 ALDH1A1 (0.60) HCAR2ATMALDH1A1TSHRTHRB

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 4559/4885ALDH1A1 1254/4885

“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.