SCHEMBL24043239

SCHEMBL24043239

CC(C)C1(C)CC(O)c2ccccc2O1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
KCNE1 P15382 1/20 0.37
KCNQ1 P51787 1/20 0.37
ABCB1 P08183 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
MAPK1 P28482 1/20 0.34
LMNA P02545 1/20 0.34
TRPV1 Q8NER1 6/20 0.34
OPRD1 P41143 1/20 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
SCHEMBL12748474 0.84 HTT (0.36) HTTKCNE1KCNQ1ABCB1MAOA
SCHEMBL12748471 0.84 HTT (0.36) HTTKCNE1KCNQ1ABCB1MAOA
SCHEMBL12748473 0.84 HTT (0.36) HTTKCNE1KCNQ1ABCB1MAOA
SCHEMBL31253977 0.81 MEN1 (0.43) HTTKCNE1KCNQ1MAOAMAOB
SCHEMBL3580439 0.81 MEN1 (0.43) HTTKCNE1KCNQ1MAOAMAOB
SCHEMBL13573386 0.81 MEN1 (0.43) HTTKCNE1KCNQ1MAOAMAOB
SCHEMBL15021653 0.81 MEN1 (0.43) HTTKCNE1KCNQ1MAOAMAOB
SCHEMBL5733934 0.78 KCNE1 (0.38) HTTKCNE1KCNQ1MAOAMAOB
SCHEMBL24043241 0.78 SCD (0.35) HTTABCB1MAPK1LMNAOPRD1
Alcohol SCHEMBL10531474 0.75 KCNE1 (0.42) HTTKCNE1KCNQ1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018133-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2024-01-18 US disclosed
US-20240018133-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2024-01-18 US disclosed
US-20210363136-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2021-11-25 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-20210363136-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 HTT 2483/4885KCNE1 4728/4885KCNQ1 4615/4885
US-20240018133-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 HTT 2483/4885KCNE1 4728/4885KCNQ1 4615/4885

“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.