SCHEMBL6903397

SCHEMBL6903397

CCCCCCCC1(CC)CO1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL10869456 1.00 SIRT2 (0.39) SIRT2TSHRTHRB
SCHEMBL10871192 1.00 SIRT2 (0.39) SIRT2TSHRTHRB
SCHEMBL10870841 1.00 SIRT2 (0.39) SIRT2TSHRTHRB
SCHEMBL11806323 1.00 SIRT2 (0.39) SIRT2TSHRTHRB
SCHEMBL10871240 1.00 SIRT2 (0.39) SIRT2TSHRTHRB
SCHEMBL10870184 1.00 SIRT2 (0.39) SIRT2TSHRTHRB
SCHEMBL10870346 1.00 SIRT2 (0.39) SIRT2TSHRTHRB
SCHEMBL6898552 1.00 SIRT2 (0.39) SIRT2TSHRTHRB
SCHEMBL10870927 1.00 SIRT2 (0.39) SIRT2TSHRTHRB
SCHEMBL10869182 1.00 SIRT2 (0.39) SIRT2TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1122235-B1 Process for preparing 1,3-alkanediol from epoxide derivative DAVY PROCESS TECHN LTD (GB) 2004-09-15 EP disclosed
US-6600065-B2 Process for preparing 3-hydroxyesters from epoxide derivatives DAVY PROCESS TECHNOLOGY LTD. (GB) 2003-07-29 US disclosed
US-20030109744-A1 PROCESS FOR PREPARING 3-HYDROXYESTERS FROM EPOXIDE DERIVATIVES DAVY PROCESS TECHNOLOGY LTD. (GB) 2003-06-12 US disclosed
EP-1304321-A2 Process for preparing 3-Hydroxyesters from epoxide derivatives SAMSUNG ELECTRONICS CO., LTD. (KR) 2003-04-23 EP disclosed
CN-1412173-A Process for preparing 3-hydroxy ester from epoxide derivative SAMSUNG ELECTRONICS CO LTD (KR) 2003-04-23 CN disclosed
US-6541414-B2 For preparing an 1,3-alkanediol through carbonylation of an epoxide derivative SAMSUNG ELECTRONICS CO., LTD. (KR) 2003-04-01 US disclosed
US-6521801-B2 Catalytic carbonylation of epoxide derivative includes reacting with alcohol and carbon monoxide to form hydroxyester which is hydrogenated to form diol SAMSUNG ELECTRONICS CO., LTD. (KR) 2003-02-18 US disclosed
US-6465680-B2 USING COBALT CATALYST AND PROMOTER SAMSUNG ELECTRONICS CO., LTD. (KR) 2002-10-15 US disclosed
US-20020099245-A1 For preparing an 1,3-alkanediol through carbonylation of an epoxide derivative SAMSUNG ELECTRONICS CO., LTD (KR) 2002-07-25 US disclosed
US-20020065439-A1 Catalytic carbonylation of epoxide derivative includes reacting with alcohol and carbon monoxide to form hydroxyester which is hydrogenated to form diol DAVY PROCESS TECHNOLOGY LIMITED (GB) 2002-05-30 US disclosed
US-20020035290-A1 Process for preparing malonate derivatives or beta -keto esters from epoxide derivatives SAMSUNG ELECTRONICS CO., LTD. 2002-03-21 US disclosed
US-6348632-B1 Process for preparing 1,3-alkanediol from epoxide derivative SAMSUNG ELECTRONICS CO. LTD. (KR) 2002-02-19 US disclosed
CN-1330064-A Method for producing malonate derivative or beta-ket-acid ester by epoxide derivative SAMSUNG ELECTRONICS CO LTD (KR) 2002-01-09 CN disclosed
EP-1122235-A2 Process for preparing 1,3-alkanediol from epoxide derivative SAMSUNG ELECTRONICS CO., LTD. (KR) 2001-08-08 EP disclosed
US-3935152-A THERMOPLASTIC, EPOXY COMPOUND DAICEL LTD. (JA) 1976-01-27 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 (4 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-20020099245-A1 For preparing an 1,3-alkanediol through carbonylation of an epoxide derivative CYP2E1, ADH1C, OR51E2 SIRT2 2213/4885TSHR 4684/4885THRB 4559/4885
US-20020035290-A1 Process for preparing malonate derivatives or beta -keto esters from epoxide derivatives CYP4A11, ME1, CYP2E1 SIRT2 3712/4885TSHR 4610/4885THRB 3166/4885
US-20030109744-A1 PROCESS FOR PREPARING 3-HYDROXYESTERS FROM EPOXIDE DERIVATIVES CYP2E1, HMOX2, CYP4A11 SIRT2 4538/4885TSHR 4173/4885THRB 3933/4885
US-20020065439-A1 Catalytic carbonylation of epoxide derivative includes reacting with alcohol and carbon monoxide to form hydroxyester which is hydrogenated to form diol CYP2E1, ADH1C, ADH1A SIRT2 3204/4885TSHR 4712/4885THRB 4321/4885

“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.