SCHEMBL16576809

SCHEMBL16576809

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

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31
▸ MLYCD O95822 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
SCHEMBL16576812 0.75 MCL1 (0.43) ALDH1A1
SCHEMBL16576817 0.75 KDM4E (0.30) —
SCHEMBL16576807 0.70 GSK3B (0.31) —
SCHEMBL8617735 0.66 ALDH1A1 (0.39) ALDH1A1MLYCD
SCHEMBL720540 0.64 HTT (0.54) ALDH1A1
SCHEMBL4653953 0.62 KDM4E (0.49) ALDH1A1
SCHEMBL721535 0.62 PKM (0.58) —
SCHEMBL12249331 0.62 KDM4E (0.31) —
SCHEMBL716858 0.61 KDM4E (0.48) ALDH1A1
SCHEMBL718499 0.61 MAPT (0.57) ALDH1A1

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 ALDH1A1 1461/4885MLYCD 768/4885

“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.

Send feedback