SCHEMBL23680474

SCHEMBL23680474

CC(C)(C)OC(=O)N[C@H](CN[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(CO)cc1)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.48
APP P05067 4/20 0.46
HDAC8 Q9BY41 2/20 0.44
CTSK P43235 4/20 0.42
CTSS P25774 3/20 0.42
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
ITGB3 P05106 1/20 0.41
ITGB1 P05556 1/20 0.41
ITGAV P06756 1/20 0.41
ITGA2B P08514 1/20 0.41
ITGB5 P18084 1/20 0.41
HDAC4 P56524 2/20 0.41
HDAC1 Q13547 2/20 0.41
MMP1 P03956 1/20 0.41
MMP3 P08254 1/20 0.41
MMP9 P14780 1/20 0.41
SIRT5 Q9NXA8 1/20 0.41
AKT1 P31749 1/20 0.40
PTPN1 P18031 2/20 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
SCHEMBL23286132 0.87 HDAC8 (0.52) HDAC8CTSKCTSSCTSLCTSB
SCHEMBL3496030 0.85 SIRT5 (0.48) HDAC8CTSKCTSSHDAC4HDAC1
SCHEMBL3496034 0.85 SIRT5 (0.48) HDAC8CTSKCTSSHDAC4HDAC1
SCHEMBL19456959 0.82 MMP1 (0.53) HDAC8CTSKCTSSCTSLCTSB
SCHEMBL19456962 0.82 MMP1 (0.53) HDAC8CTSKCTSSCTSLCTSB
SCHEMBL23680475 0.81 GGT1 (0.47) SIRT5
SCHEMBL14012279 0.79 CA2 (0.46) HDAC4HDAC1MMP1MMP3MMP9
SCHEMBL20158426 0.79 CA2 (0.46) HDAC4HDAC1MMP1MMP3MMP9
SCHEMBL12283259 0.79 CA2 (0.46) HDAC4HDAC1MMP1MMP3MMP9
SCHEMBL17902993 0.79 CA2 (0.46) HDAC4HDAC1MMP1MMP3MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210230218-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREOF MABPLEX INTERNATIONAL, LTD. (CN) 2021-07-29 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-20210230218-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREOF VIP, DNPEP, PREP ATM 3275/4885APP 87/4885HDAC8 1892/4885

“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.