SCHEMBL19784261

SCHEMBL19784261

COc1cc(C(C)C)ccc1C(C)S

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
ALDH1A1 P00352 4/20 0.38
POLB P06746 2/20 0.38
GAA P10253 1/20 0.38
GFER P55789 1/20 0.38
ACHE P22303 2/20 0.37
BCHE P06276 1/20 0.37
TYR P14679 1/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
ERN1 O75460 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36

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
SCHEMBL738832 0.88 HDAC4 (0.48) HDAC4HDAC8ALDH1A1POLBGAA
SCHEMBL24371806 0.82 HDAC4 (0.44) HDAC4HDAC8ALDH1A1POLBGAA
SCHEMBL10175139 0.81 HDAC4 (0.43) HDAC4HDAC8ALDH1A1POLBACHE
SCHEMBL19783808 0.81 ACHE (0.43) ALDH1A1POLBACHEBCHEKMT2A
SCHEMBL84033 0.79 PPARG (0.53) HDAC4HDAC8ALDH1A1ACHEKMT2A
SCHEMBL24512538 0.78 PDE2A (0.38) HDAC4HDAC8ALDH1A1GAAACHE
SCHEMBL24987670 0.76 GAA (0.42) HDAC4HDAC8POLBGAAGFER
SCHEMBL20975423 0.76 PTGS2 (0.46) ALDH1A1KMT2ASMN1; SMN2CA2LMNA
SCHEMBL31465578 0.75 LMNA (0.54) HDAC4HDAC8ALDH1A1ACHEBCHE
SCHEMBL739698 0.75 HDAC4 (0.48) HDAC4HDAC8ALDH1A1POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10189925-B2 Rapid cure polymeric resins THE BOEING COMPANY (US) 2019-01-29 US disclosed
US-20180016373-A1 RAPID CURE POLYMERIC RESINS THE BOEING COMPANY 2018-01-18 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-20180016373-A1 RAPID CURE POLYMERIC RESINS TST, CTH, VCL HDAC4 2757/4885HDAC8 2960/4885ALDH1A1 2655/4885
US-10189925-B2 Rapid cure polymeric resins TST, CTH, VCL HDAC4 2757/4885HDAC8 2960/4885ALDH1A1 2655/4885

“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.