SCHEMBL6520336

SCHEMBL6520336

CC(C)OC(=O)C(C)OC(=O)/C=C/C(=O)OC(C)C(=O)OC(C)C

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 6/20 0.58
TSHR P16473 2/20 0.40
CA12 O43570 1/20 0.40
AKR1B10 O60218 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
AKR1B1 P15121 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
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
SMN1; SMN2 Q16637 1/20 0.33
ATM Q13315 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
SCHEMBL7065063 0.84 HCAR2 (0.40) HCAR2TSHRCA12AKR1B10CA1
SCHEMBL177747 0.82 HCAR2 (0.80) HCAR2TSHRCA12AKR1B10CA1
SCHEMBL177748 0.82 HCAR2 (0.80) HCAR2TSHRCA12AKR1B10CA1
SCHEMBL178194 0.82 HCAR2 (0.80) HCAR2TSHRCA12AKR1B10CA1
SCHEMBL6513306 0.81 HCAR2 (0.48) HCAR2TSHRCA12AKR1B10CA1
SCHEMBL27659116 0.79 HCAR2 (0.76) HCAR2TSHRCA12AKR1B10CA1
SCHEMBL11556027 0.79 HCAR2 (0.46) HCAR2TSHRCA12AKR1B10CA1
SCHEMBL7045739 0.77 HCAR2 (0.48) HCAR2TSHRCA12CA1CA2
SCHEMBL6524281 0.77 HCAR2 (0.48) HCAR2TSHRCA12CA1CA2
SCHEMBL856012 0.77 HCAR2 (0.48) HCAR2TSHRCA12CA1CA2

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 3143/4885TSHR 3581/4885CA12 3504/4885

“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.