SCHEMBL5746089

SCHEMBL5746089

CC1CCN(C(c2ccccc2)(c2ccccc2)c2ccccc2)CC1O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.38
ATM Q13315 1/20 0.38
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
CYP2B6 P20813 1/20 0.35
KCNA3 P22001 2/20 0.35
SLC18A3 Q16572 1/20 0.35
CHRM3 P20309 5/20 0.34
ALDH1A1 P00352 1/20 0.33
CHRM2 P08172 2/20 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
SCHEMBL5746066 0.92 CYP2D6 (0.39) L3MBTL1ATMLMNAMAPTCHRM3
SCHEMBL5746039 0.87 MAPT (0.39) L3MBTL1ATMLMNAMAPTCYP2B6
SCHEMBL5745763 0.85 CYP2D6 (0.39) L3MBTL1LMNAMAPTALDH1A1
SCHEMBL5744205 0.85 MAPT (0.41) L3MBTL1ATMLMNAMAPTCYP2B6
SCHEMBL17285465 0.85 CYP2B6 (0.38) L3MBTL1ATMLMNACYP2B6KCNA3
SCHEMBL1528518 0.83 KCNA3 (0.41) L3MBTL1ATMLMNAMAPTCYP2B6
SCHEMBL2493505 0.83 KCNA3 (0.41) L3MBTL1ATMLMNAMAPTCYP2B6
SCHEMBL5744730 0.80 CYP2D6 (0.39) L3MBTL1ATMLMNAMAPTCHRM3
Ethane SCHEMBL27569967 0.80 KCNA3 (0.44) L3MBTL1ATMLMNAMAPTCYP2B6
SCHEMBL18803696 0.80 CHRM3 (0.43) L3MBTL1ATMLMNACYP2B6KCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1288198-B1 PROCESS FOR THE PRODUCTION OF SULFONIC ESTERS KANEKA CORP (JP) 2006-12-20 EP disclosed
US-6992205-B2 Process for the production of sulfonic esters KANEKA CORPORATION (JP) 2006-01-31 US disclosed
US-6864372-B2 Process for the production of sulfonic esters KANEKA CORPORATION (JP) 2005-03-08 US disclosed
US-6794519-B2 Process for the production of sulfonic esters KANEKA CORPORATION (JP) 2004-09-21 US disclosed
US-20030176713-A1 Reacting an amino alcohol derivative with organic sulfonyl halide in a mixed solvent composed of an aprotic organic solvent and water in presence of a non-water prohibiting inorganic base KANEKA CORPORATION (JP) 2003-09-18 US disclosed
US-20030176711-A1 Process for the production of sulfonic esters KANEKA CORPORATION (JP) 2003-09-18 US disclosed
US-20030162966-A1 PROCESS FOR THE PRODUCTION OF SULFONIC ESTERS KANEKA CORPORATION (JP) 2003-08-28 US disclosed
EP-1288198-A1 PROCESS FOR THE PRODUCTION OF SULFONIC ESTERS KANEKA CORPORATION (JP) 2003-03-05 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 (3 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-20030162966-A1 PROCESS FOR THE PRODUCTION OF SULFONIC ESTERS TST, STS, SELENOI L3MBTL1 3101/4885ATM 1297/4885LMNA 3382/4885
US-20030176711-A1 Process for the production of sulfonic esters TST, STS, SELENOI L3MBTL1 3101/4885ATM 1297/4885LMNA 3382/4885
US-20030176713-A1 Reacting an amino alcohol derivative with organic sulfonyl halide in a mixed solvent composed of an aprotic organic solvent and water in presence of a non-water prohibiting inorganic base BRAF, ADH1C, TST L3MBTL1 2186/4885ATM 894/4885LMNA 2764/4885

“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.