SCHEMBL528601

SCHEMBL528601

C=C(C)C(=O)OCCCCC#N

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.59
THRB P10828 1/20 0.47
POLB P06746 1/20 0.45
APEX1 P27695 1/20 0.45
HTT P42858 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 5/20 0.37
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP3A4 P08684 1/20 0.31
DNM1 Q05193 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
SCHEMBL11774726 0.98 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL7061249 0.98 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL10409035 0.98 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL530161 0.94 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
Acrylic Acid SCHEMBL27993445 0.91 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL33780 0.86 THRB (0.52) TSHRTHRBPOLBAPEX1HTT
SCHEMBL5144090 0.84 TSHR (0.79) TSHRTHRBPOLBAPEX1HTT
SCHEMBL25426 0.84 TSHR (0.79) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28008586 0.84 TSHR (0.42) TSHRTHRBPOLBAPEX1HTT
Acetic Acid SCHEMBL28158415 0.83 THRB (0.48) TSHRTHRBPOLBAPEX1HTT

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 517 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060121387-A1 Toner processes XEROX CORPORATION 2006-06-08 US claimed
US-6664017-B1 Document security processes XEROX CORPORATION 2003-12-16 US claimed
US-5385803-A Authentication process XEROX CORPORATION (US) 1995-01-31 US claimed
US-5334471-A Free-flowing toner comprising a mixture of shell-core polymers , low remanence magnetite and light scattering component XEROX CORPORATION (US) 1994-08-02 US claimed
US-5304448-A Encapsulated toner compositions XEROX CORPORATION (US) 1994-04-19 US claimed
US-5223370-A Low gloss toner compositions and processes thereof XEROX CORPORATION (US) 1993-06-29 US claimed
US-5215855-A Encapsulated toner compositions XEROX CORPORATION (US) 1993-06-01 US claimed
US-5204208-A Mixing at least two toners of different dyes or pigments XEROX CORPORATION (US) 1993-04-20 US claimed
US-5175071-A Encapsulated toner composition XEROX CORPORATION (US) 1992-12-29 US claimed
US-5153089-A Encapsulated toner compositions and processes thereof XEROX CORPORATION (US) 1992-10-06 US claimed
US-5153093-A Overcoated encapsulated toner compositions and processes thereof XEROX CORPORATION (US) 1992-10-06 US claimed
US-5147744-A MICR processes with colored encapsulated compositions XEROX CORPORATION (US) 1992-09-15 US claimed
US-5135832-A COLORED TONER COMPOSITIONS XEROX CORPORATION (US) 1992-08-04 US claimed
US-5114819-A Magnetic encapsulated toner compositions XEROX CORPORATION (US) 1992-05-19 US claimed
US-5082757-A Encapsulated toner compositions XEROX CORPORATION (US) 1992-01-21 US claimed
US-5080986-A Magnetic image character recognition processes with encapsulated toners XEROX CORPORATION (US) 1992-01-14 US claimed
US-5077167-A Encapsulated toner compositions XEROX CORPORATION (US) 1991-12-31 US claimed
US-12597609-B2 Positive electrode plate, secondary battery and power consuming device CONTEMPORARY AMPEREX TECHNOLOGY (HONG KONG) LIMITED (CN) 2026-04-07 US disclosed
US-4942906-A FOR FUEL TRANSPORTATION TOKAI RUBBER INDUSTRIES, LTD. (JP) 1990-07-24 US disclosed
US-4021397-A LATEX, HYDROXYLAMINE SULFATE THE B. F. GOODRICH COMPANY (US) 1977-05-03 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-12597609-B2 Positive electrode plate, secondary battery and power consuming device SCO2, CACNA2D4, CACNA2D1 TSHR 2946/4885THRB 1304/4885POLB 268/4885

“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.