SCHEMBL10216111

SCHEMBL10216111

C=C(C)C(=O)OCCNC(=O)OCCO

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.54
THRB P10828 1/20 0.44
TSHR P16473 3/20 0.43
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41

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
SCHEMBL2403793 0.91 THRB (0.53) ACHETHRBTSHR
SCHEMBL13872030 0.91 THRB (0.53) ACHETHRBTSHR
SCHEMBL3821239 0.91 THRB (0.51) ACHETHRBTSHRCHRNB2CHRNB4
SCHEMBL21404625 0.91 THRB (0.51) ACHETHRBTSHRCHRNB2CHRNB4
SCHEMBL14998171 0.90 ACHE (0.51) ACHETHRBTSHRCHRNB2CHRNB4
SCHEMBL21404666 0.89 THRB (0.53) ACHETHRBTSHRCHRNB2CHRNB4
SCHEMBL21404715 0.89 THRB (0.53) ACHETHRBTSHRCHRNB2CHRNB4
SCHEMBL26735492 0.89 ACHE (0.58) ACHETHRBTSHR
SCHEMBL92093 0.88 THRB (0.43) ACHETHRBTSHR
SCHEMBL14984891 0.88 THRB (0.46) ACHETHRBTSHR

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
US-20200057370-A1 COMPOUND, RESIST COMPOSITION CONTAINING COMPOUND AND PATTERN FORMATION METHOD USING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2020-02-20 US disclosed
US-8454689-B2 Brush copolymers BAUSCH & LOMB INCORPORATED (US) 2013-06-04 US disclosed
US-8426490-B2 Methacrylate based monomers containing a urethane linkage, process for production and use thereof 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-04-23 US disclosed
US-20120107530-A1 Printing paper for printing stereoscopic image, stereoscopic image printed matter, and method for providing stereoscopic image FUJIFILM CORPORATION (JP) 2012-05-03 US disclosed
WO-2011040628-A1 COLORANT MULTIMER, COLORED CURABLE COMPOSITION, COLOR FILTER AND METHOD FOR PRODUCING THE SAME, AND SOLID-STATE IMAGE SENSOR, IMAGE DISPLAY DEVICE, LIQUID CRYSTAL DISPLAY DEVICE AND ORGANIC EL DISPLAY WITH THE COLOR FILTER FUJIFILM CORPORATION (JP) 2011-04-07 WO disclosed
WO-2011005937-A2 MONO ETHYLENICALLY UNSATURATED POLYMERIZABLE GROUP CONTAINING POLYCARBOSILOXANE MONOMERS BAUSCH & LOMB INCORPORATED (US) 2011-01-13 WO disclosed
US-20100168852-A1 Brush Copolymers SALIX PHARMACEUTICALS, INC. 2010-07-01 US disclosed
US-20100162661-A1 Packaging Solutions VALEANT PHARMA POLAND SP. Z O.O. (PL) 2010-07-01 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-20200057370-A1 COMPOUND, RESIST COMPOSITION CONTAINING COMPOUND AND PATTERN FORMATION METHOD USING SAME CROCC, BICRA, TTC14 ACHE 3658/4885THRB 4551/4885TSHR 4638/4885

“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.