SCHEMBL2866518

SCHEMBL2866518

C=C(C)CCCC(OCCCC)=C(C)C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
TSHR P16473 5/20 0.39
HPGD P15428 1/20 0.37
ATM Q13315 1/20 0.35
HCAR2 Q8TDS4 1/20 0.32
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 2/20 0.31
BTN3A1 O00481 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NAAA Q02083 1/20 0.31
DGKA P23743 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
SCHEMBL2870663 0.90 TSHR (0.32) ALDH1A1TSHRBTN3A1
SCHEMBL2859462 0.82 ALDH1A1 (0.32) ALDH1A1
SCHEMBL2864117 0.78 CA12 (0.36) CA12CA1CA2CA9
SCHEMBL10826114 0.77 DGKA (0.57) ALDH1A1TSHRHPGDATMNAAA
SCHEMBL6883385 0.73 TSHR (0.52) ALDH1A1TSHRHPGDBTN3A1
SCHEMBL2860817 0.73 TSHR (0.33) TSHR
SCHEMBL10573305 0.72 DGKA (0.60) ALDH1A1TSHRL3MBTL1NAAADGKA
SCHEMBL108471 0.71
SCHEMBL10826473 0.70 DGKA (0.63) ALDH1A1TSHRNAAADGKA
SCHEMBL10410456 0.70 DGKA (0.63) ALDH1A1TSHRNAAADGKA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7728180-B2 Method for producing ethers KURARAY CO., LTD. (JP) 2010-06-01 US disclosed
US-20080262272-A1 Method For Producing Ethers KURARAY CO., LTD. (JP) 2008-10-23 US disclosed
CN-1972888-A Method for producing ethers KURARAY CO (JP) 2007-05-30 CN disclosed
EP-1760061-A1 METHOD FOR PRODUCING ETHERS KURARAY CO., LTD. (JP) 2007-03-07 EP 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-20080262272-A1 Method For Producing Ethers TELO2, PDS5A, TERT ALDH1A1 3068/4885TSHR 657/4885HPGD 1119/4885

“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.