SCHEMBL6513306

SCHEMBL6513306

COC(=O)C(C)OC(=O)/C=C/C(=O)OC(C)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.48
KEAP1 Q14145 1/20 0.48
NFE2L2 Q16236 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.39
CA14 Q9ULX7 3/20 0.37
CA12 O43570 2/20 0.34
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
AKR1B10 O60218 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
AKR1B1 P15121 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
ATM Q13315 1/20 0.32
GFPT1 Q06210 1/20 0.32
TSHR P16473 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
SCHEMBL11556027 0.98 HCAR2 (0.46) HCAR2KEAP1NFE2L2SMN1; SMN2CA14
SCHEMBL4673026 0.84 SMN1; SMN2 (0.38) HCAR2KEAP1NFE2L2SMN1; SMN2CA14
SCHEMBL1657002 0.82 TSHR (0.47) HCAR2KEAP1NFE2L2SMN1; SMN2CA14
SCHEMBL6520336 0.81 HCAR2 (0.58) HCAR2KEAP1NFE2L2SMN1; SMN2CA14
SCHEMBL4642318 0.78 HCAR2 (0.46) HCAR2KEAP1NFE2L2KDM4EMAPT
SCHEMBL2114189 0.77 HCAR2 (0.56) HCAR2KEAP1NFE2L2SMN1; SMN2CA14
SCHEMBL2114191 0.77 HCAR2 (0.56) HCAR2KEAP1NFE2L2SMN1; SMN2CA14
SCHEMBL7045739 0.77 HCAR2 (0.48) HCAR2CA14CA12MAPTCA1
SCHEMBL856012 0.77 HCAR2 (0.48) HCAR2CA14CA12MAPTCA1
SCHEMBL6524281 0.77 HCAR2 (0.48) HCAR2CA14CA12MAPTCA1

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 3143/4885KEAP1 1276/4885NFE2L2 2412/4885

“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.