SCHEMBL29455258

SCHEMBL29455258

CC(C)(C)OC(=O)C[C@H](NC(=O)CCCCCSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE P12821 1/20 0.43
FAAH O00519 2/20 0.38
VCAM1 P19320 1/20 0.37
HDAC6 Q9UBN7 5/20 0.37
HDAC1 Q13547 4/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
KIF11 P52732 3/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
KCNH2 Q12809 1/20 0.36

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
SCHEMBL30787952 0.96 ACE (0.44) ACEVCAM1PPARGPPARAKIF11
SCHEMBL30093819 0.90 HDAC6 (0.41) FAAHHDAC6HDAC1KIF11
SCHEMBL29455274 0.86 ITGB3 (0.41) FAAHHDAC6HDAC1KIF11
SCHEMBL13753519 0.83 GPR88 (0.37) ACEFAAHHDAC6KIF11
SCHEMBL22415062 0.81 PTPN1 (0.42) ACEKIF11
SCHEMBL18735705 0.80 HDAC3 (0.39) FAAHHDAC6HDAC1KIF11
SCHEMBL17193610 0.78 KIF11 (0.37) KIF11
SCHEMBL4835726 0.78 KIF11 (0.42) KIF11
SCHEMBL23001074 0.77 NOD1 (0.57) FAAH
SCHEMBL17817607 0.77 NOD1 (0.57) FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250127797-A1 PRODRUG COMPRISING A DRUG-LINKER CONJUGATE ASCENDIS PHARMA A/S (DK) 2025-04-24 US disclosed
US-20240041897-A1 PRODRUG COMPRISING A DRUG LINKER CONJUGATE ASCENDIS PHARMA GMBH (DE) 2024-02-08 US disclosed
US-20220331334-A1 Prodrug Comprising a Drug-Linker Conjugate ASCENDIS PHARMA A/S (DK) 2022-10-20 US disclosed
EP-3981761-A2 INTERMEDIATES FOR PRODRUGS Ascendis Pharma A/S (DK) 2022-04-13 EP 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 (3 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-20240041897-A1 PRODRUG COMPRISING A DRUG LINKER CONJUGATE H1-0, H1-3, H1-2 ACE 1053/4885FAAH 1647/4885VCAM1 3280/4885
US-20220331334-A1 Prodrug Comprising a Drug-Linker Conjugate H1-0, H1-3, DLST ACE 915/4885FAAH 1624/4885VCAM1 3100/4885
US-20250127797-A1 PRODRUG COMPRISING A DRUG-LINKER CONJUGATE H1-0, H1-3, DLST ACE 915/4885FAAH 1624/4885VCAM1 3100/4885

“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.