SCHEMBL19734501

SCHEMBL19734501

CC(C)(C)c1cccc(C(O)(C(F)(F)F)C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.50
HDAC4 P56524 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
NR1H3 Q13133 8/20 0.45
MEN1 O00255 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NR1H2 P55055 6/20 0.44
RORC P51449 3/20 0.44
RORA P35398 2/20 0.44
PGR P06401 1/20 0.43
AR P10275 2/20 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
SCHEMBL832913 0.89 NR1H3 (0.47) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL26548517 0.86 NR1H3 (0.44) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL24436844 0.86 NR1H3 (0.44) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL10165246 0.86 NR1H3 (0.44) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL17914398 0.83 ACHE (0.50) ACHEHDAC4HDAC2HDAC8ALOX15
SCHEMBL29509593 0.83 TSHR (0.50) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL24901407 0.83 TSHR (0.50) NR1H3MEN1ALOX15TSHRMAPK1
SCHEMBL22928005 0.83 ACHE (0.53) ACHEHDAC4HDAC2HDAC8MEN1
SCHEMBL9095009 0.83 ACHE (0.53) ACHEHDAC4HDAC2HDAC8MEN1
SCHEMBL23059982 0.82 GABRA1 (0.50) NR1H3MEN1ALOX15TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230039535-A1 COMPOSITION, COMPOSITION PRECURSOR SOLUTION, PRODUCTION METHOD FOR COMPOSITION, SUBSTRATE WITH MULTILAYER FILM, AND PRODUCTION METHOD FOR PATTERNED SUBSTRATE CENTRAL GLASS COMPANY, LIMITED (JP) 2023-02-09 US disclosed
US-20210082690-A1 Silicon-Containing Layer-Forming Composition, and Method for Producing Pattern-Equipped Substrate Which Uses Same CENTRAL GLASS COMPANY, LIMITED (JP) 2021-03-18 US disclosed
US-20210061827-A1 Silicon Compound Containing Hexafluoroisopropanol Group, and Method for Producing Same CENTRAL GLASS COMPANY, LIMITED (JP) 2021-03-04 US disclosed
US-9874816-B2 Radiation-sensitive resin composition and resist pattern-forming method JSR CORPORATION (JP) 2018-01-23 US disclosed
US-20170363961-A9 RADIATION-SENSITIVE RESIN COMPOSITION AND RESIST PATTERN-FORMING METHOD JSR CORPORATION (JP) 2017-12-21 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-20210061827-A1 Silicon Compound Containing Hexafluoroisopropanol Group, and Method for Producing Same FOS, FUBP3, SF3A3 ACHE 3458/4885HDAC4 2105/4885HDAC2 429/4885

“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.