SCHEMBL16576807

SCHEMBL16576807

Cc1c(C)c(C)c2c(=O)c(C)c(C(=O)CBr)oc2c1C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 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
SCHEMBL16576817 0.79 KDM4E (0.30) —
SCHEMBL16576812 0.79 MCL1 (0.43) —
SCHEMBL16576809 0.70 ALDH1A1 (0.31) —
SCHEMBL12249331 0.65 KDM4E (0.31) —
SCHEMBL12558040 0.60 KDM4E (0.40) —
SCHEMBL31155758 0.60 KDM4E (0.40) —
SCHEMBL14286794 0.59 ALOX5 (0.37) —
SCHEMBL15423096 0.59 ESR2 (0.38) —
SCHEMBL805033 0.59 — —
SCHEMBL6122310 0.58 ALDH1A1 (0.42) GSK3B

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-9914722-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2018-03-13 — — US disclosed
US-20150080383-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS, INC. 2015-03-19 — — 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-20150080383-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, CPT1B, GYS1 GSK3B 525/4885

“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.

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