SCHEMBL16576817

SCHEMBL16576817

CC(=O)c1oc2c(C)c(C)c(C)c(C)c2c(=O)c1C

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL16576812 0.85 MCL1 (0.43) KDM4E
SCHEMBL16576807 0.79 GSK3B (0.31) —
SCHEMBL16576809 0.75 ALDH1A1 (0.31) —
SCHEMBL12249331 0.69 KDM4E (0.31) KDM4E
SCHEMBL13840560 0.65 KDM4E (0.40) KDM4EMAPTMAPK1
SCHEMBL12558040 0.65 KDM4E (0.40) KDM4EMAPTMAPK1
SCHEMBL14286794 0.63 ALOX5 (0.37) MAPT
SCHEMBL15423096 0.63 ESR2 (0.38) KDM4EMAPT
SCHEMBL25177428 0.63 POLB (0.33) —
SCHEMBL12440753 0.61 ESR2 (0.37) KDM4EMAPTMAPK1

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 KDM4E 1926/4885MAPT 207/4885MAPK1 3878/4885

“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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