SCHEMBL6523073

SCHEMBL6523073

CCOCCOC(=O)/C=C/C(=O)OCC(=O)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
TSHR P16473 1/20 0.39
ATM Q13315 1/20 0.38
HCAR2 Q8TDS4 5/20 0.36
THRB P10828 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 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
SCHEMBL6519440 0.89 ATM (0.50) ALDH1A1TSHRATMHCAR2MEN1
SCHEMBL6519734 0.86 HCAR2 (0.47) ALDH1A1ATMHCAR2THRBTDP1
SCHEMBL6515419 0.84 CES2 (0.39) ALDH1A1TSHRATMTHRBTDP1
SCHEMBL6520377 0.84 ATM (0.59) ALDH1A1TSHRATMHCAR2RAB9A
SCHEMBL6523557 0.84 ATM (0.37) ALDH1A1ATMHCAR2THRBL3MBTL1
SCHEMBL6521104 0.83 ALDH1A1 (0.39) ALDH1A1ATMHCAR2THRBTDP1
SCHEMBL6521048 0.79 HCAR2 (0.45) ALDH1A1HCAR2THRBTDP1L3MBTL1
SCHEMBL2897724 0.78 ALDH1A1 (0.60) ALDH1A1TSHRATMHCAR2THRB
SCHEMBL2898088 0.78 ALDH1A1 (0.60) ALDH1A1TSHRATMHCAR2THRB
SCHEMBL27436999 0.76 ALDH1A1 (0.47) ALDH1A1TSHRATMTHRBL3MBTL1

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 ALDH1A1 1254/4885TSHR 3581/4885ATM 4559/4885

“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.