SCHEMBL29613490

SCHEMBL29613490

CC(C)(C)c1ccc(C(=O)NCCOCCOCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)OCc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 2/20 0.44
TLR2 O60603 3/20 0.43
CPB1 P15086 1/20 0.42
CPB2 Q96IY4 1/20 0.42
CBX4 O00257 2/20 0.42
CBX7 O95931 2/20 0.42
CDYL2 Q8N8U2 2/20 0.42
CBX8 Q9HC52 2/20 0.42
EPOR P19235 1/20 0.42
SIRT2 Q8IXJ6 2/20 0.41
SIRT1 Q96EB6 2/20 0.41
SIRT3 Q9NTG7 2/20 0.41
PRSS1 P07477 5/20 0.41
PRSS2 P07478 5/20 0.41
PRSS3 P35030 5/20 0.41
TPSAB1 Q15661 5/20 0.41
CA2 P00918 1/20 0.41
PRKACA P17612 1/20 0.40
AKT3 Q9Y243 1/20 0.40
GRIN1 Q05586 1/20 0.40

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
SCHEMBL29613487 0.90 CDYL2 (0.48) CBX4CBX7CDYL2CBX8SIRT2
SCHEMBL29129114 0.89 CA2 (0.47) ROCK2TLR2CA2PRKACAAKT3
SCHEMBL29613403 0.85 KMT2A (0.41) TLR2CBX4CBX7CDYL2CBX8
SCHEMBL29129144 0.79 CBX4 (0.44) CBX4CBX7CDYL2CBX8SIRT2
SCHEMBL23475254 0.78 SIRT2 (0.46) TLR2CPB1CPB2SIRT2SIRT1
SCHEMBL29129094 0.77 KMT2A (0.43) TLR2TPSAB1
SCHEMBL23447173 0.76 MEN1 (0.44) ROCK2TLR2CPB1CPB2EPOR
SCHEMBL29613443 0.76 CDYL2 (0.70) CPB1CPB2CBX4CBX7CDYL2
SCHEMBL23446284 0.72 MEN1 (0.49) TLR2
SCHEMBL22301191 0.72 MEN1 (0.45) TLR2

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-20240166693-A1 METHODS AND COMPOUNDS FOR MODULATING MYOTONIC DYSTROPY 1 Design Therapeutics, Inc. 2024-05-23 US disclosed
EP-4259133-A1 METHODS AND COMPOUNDS FOR MODULATING MYOTONIC DYSTROPHY 1 Design Therapeutics, Inc. (US) 2023-10-18 EP disclosed
WO-2022126000-A1 METHODS AND COMPOUNDS FOR MODULATING MYOTONIC DYSTROPHY 1 Design Therapeutics, Inc. (US) 2022-06-16 WO 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-20240166693-A1 METHODS AND COMPOUNDS FOR MODULATING MYOTONIC DYSTROPY 1 MTPN, DMPK, MBNL1 ROCK2 4110/4885TLR2 4702/4885CPB1 2874/4885

“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.