SCHEMBL6516121

SCHEMBL6516121

CC(C)COC(=O)COC(=O)/C=C/C(=O)OCC(=O)OCC(C)C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HPGD P15428 1/20 0.43
HCAR2 Q8TDS4 4/20 0.38
ATM Q13315 1/20 0.38
MAPT P10636 3/20 0.35
PRKCA P17252 1/20 0.35
POLB P06746 2/20 0.35
PPARG P37231 1/20 0.35
NCOA2 Q15596 1/20 0.35
NCOA1 Q15788 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
GAA P10253 1/20 0.35
MDM4 O15151 1/20 0.33
LMNA P02545 1/20 0.33
MDM2 Q00987 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
SCHEMBL429885 0.84 TSHR (0.67) TSHRALDH1A1HPGDHCAR2ATM
SCHEMBL317107 0.84 TSHR (0.67) TSHRALDH1A1HPGDHCAR2ATM
SCHEMBL317108 0.84 TSHR (0.67) TSHRALDH1A1HPGDHCAR2ATM
SCHEMBL28757749 0.82 TSHR (0.64) TSHRALDH1A1HPGDHCAR2ATM
SCHEMBL2582183 0.78 TSHR (0.59) TSHRALDH1A1HPGDHCAR2ATM
SCHEMBL17041841 0.78 TSHR (0.48) TSHRTDP1L3MBTL1ALDH1A1POLB
SCHEMBL6448408 0.77 HCAR2 (0.59) TSHRALDH1A1HPGDHCAR2ATM
SCHEMBL6522615 0.77 HCAR2 (0.48) TSHRTDP1HCAR2ATMMAPT
SCHEMBL18235502 0.77 TSHR (0.57) TSHRALDH1A1HPGDHCAR2ATM
SCHEMBL17324979 0.77 TSHR (0.57) TSHRTDP1ALDH1A1HPGDHCAR2

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 TSHR 3581/4885TDP1 1789/4885L3MBTL1 1615/4885

“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.