SCHEMBL117533

SCHEMBL117533

CC(OCCO)C(C)(C)O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL15119486 0.82 ACHE (0.31)
SCHEMBL7952676 0.82 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1
SCHEMBL20184211 0.81
SCHEMBL27973537 0.79 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL15119481 0.78
Water SCHEMBL5790242 0.76
SCHEMBL15119457 0.76
SCHEMBL14748857 0.76
SCHEMBL8989296 0.75 DPP4 (0.35) ALDH1A1TSHRMAPK1
SCHEMBL15119477 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3558500-A1 DRAWN SILICONE MEMBRANES Wacker Chemie AG (DE) 2019-10-30 EP disclosed
CN-110049811-A stretched silicone film 瓦克化学股份公司 2019-07-23 CN disclosed
US-20150218334-A1 POROUS MEMBRANES MADE OF CROSS-LINKABLE SILICONE COMPOSITIONS WACKER CHEMIE AG (DE) 2015-08-06 US disclosed
CN-104602795-A Porous membranes made from crosslinkable silicone compositions WACKER CHEMIE AG 2015-05-06 CN disclosed
CN-102413931-B Alkoxylation of fluorinated alcohols DU PONT 2014-05-07 CN disclosed
CN-102413931-A Alkoxylation of fluorinated alcohols DU PONT 2012-04-11 CN disclosed
EP-2424662-A1 ALKOXYLATION OF FLUORINATED ALCOHOLS E. I. du Pont de Nemours and Company (US) 2012-03-07 EP disclosed
US-8053606-B2 Alkoxylation of fluorinated alcohols E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-11-08 US disclosed
US-8039677-B2 Fluoroalkylalkoxylates E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-10-18 US disclosed
WO-2010127221-A1 ALKOXYLATION OF FLUORINATED ALCOHOLS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-11-04 WO disclosed
US-20100280281-A1 ALKOXYLATION OF FLUORINATED ALCOHOLS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-11-04 US disclosed
US-20100280280-A1 FLUOROALKYLALKOXYLATES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-11-04 US disclosed
US-3979311-A MIXTURE OF AN ALKYNYL CYCLOALKANOL AND AN N,N'-DICYCLOALKYL-THIOUREA UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-09-07 US disclosed
US-3969260-A ALKYNYL CYCLOALKANOL, N,N'-DICYCLOALKYL THIOUREA, POLYAMINOMETHYLENEPHOSPHONATE UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-07-13 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 (2 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-20100280280-A1 FLUOROALKYLALKOXYLATES ADH1A, AKR7A2, ALKBH3 ALDH1A1 326/4885TSHR 2308/4885MAPK1 2924/4885
US-20100280281-A1 ALKOXYLATION OF FLUORINATED ALCOHOLS ADH1A, ADH1C, ADH5 ALDH1A1 171/4885TSHR 2100/4885MAPK1 2741/4885

“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.