SCHEMBL97796

SCHEMBL97796

C=C(C)C(=O)OCCCCC(F)(F)S(=O)(=O)O

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.51
THRB P10828 1/20 0.41
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL18758066 0.85 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL97696 0.85 TSHR (0.49) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28068158 0.82 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL9303527 0.82 TSHR (0.59) TSHRTHRBPOLBAPEX1HTT
SCHEMBL11964329 0.81 TSHR (0.51) TSHRTHRBPOLBAPEX1HTT
SCHEMBL13486939 0.81 TSHR (0.54) TSHRTHRBPOLBAPEX1HTT
SCHEMBL13024908 0.80 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL1419276 0.80 TSHR (0.62) TSHRTHRBPOLBAPEX1HTT
SCHEMBL28866183 0.80 TSHR (0.58) TSHRTHRBPOLBAPEX1HTT
SCHEMBL9301950 0.80 TSHR (0.62) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8470513-B2 Radiation-sensitive resin composition and polymer JSR CORPORATION (JP) 2013-06-25 US disclosed
US-20120070783-A1 RADIATION-SENSITIVE RESIN COMPOSITION, POLYMER, AND METHOD FOR FORMING RESIST PATTERN JSR CORPORATION (JP) 2012-03-22 US disclosed
US-20120058429-A1 RADIATION-SENSITIVE RESIN COMPOSITION AND POLYMER JSR CORPORATION (JP) 2012-03-08 US disclosed
US-7897821-B2 Sulfonium compound JSR CORPORATION (JP) 2011-03-01 US disclosed
US-7812105-B2 Compound, polymer, and radiation-sensitive composition JSR CORPORATION (JP) 2010-10-12 US disclosed
US-20090069521-A1 Novel Compound, Polymer, and Radiation-Sensitive Composition JSR CORPORATION (JP) 2009-03-12 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-20090069521-A1 Novel Compound, Polymer, and Radiation-Sensitive Composition MRE11, RAD51, MRPS22 TSHR 2355/4885THRB 3997/4885POLB 947/4885

“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.