SCHEMBL25100471

SCHEMBL25100471

CC(C)(C)N[C@@H](CCCNC(N)=O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ C3AR1 Q16581 1/20 0.44
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ FOLH1 Q04609 8/20 0.40
▸ CTDSP1 Q9GZU7 1/20 0.38
▸ SHMT1 P34896 1/20 0.37
▸ KLK7 P49862 1/20 0.36
▸ NOD1 Q9Y239 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TGM2 P21980 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ OTC P00480 1/20 0.33

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
SCHEMBL20221707 0.87 MEN1 (0.40) C3AR1MEN1KMT2AGAAFOLH1
SCHEMBL23690778 0.87 MEN1 (0.40) C3AR1MEN1KMT2AGAAFOLH1
SCHEMBL21152809 0.85 C3AR1 (0.35) C3AR1MEN1KMT2AGAAFOLH1
SCHEMBL24591799 0.82 SIRT6 (0.35) C3AR1MEN1KMT2AGAAFOLH1
SCHEMBL13167779 0.81 FOLH1 (0.59) MEN1KMT2AGAAFOLH1SMN1; SMN2
SCHEMBL19381704 0.81 FOLH1 (0.59) MEN1KMT2AGAAFOLH1SMN1; SMN2
SCHEMBL93364 0.81 C3AR1 (0.47) C3AR1MEN1KMT2AGAAFOLH1
SCHEMBL30404095 0.81 C3AR1 (0.47) C3AR1MEN1KMT2AGAAFOLH1
SCHEMBL93363 0.81 C3AR1 (0.47) C3AR1MEN1KMT2AGAAFOLH1
SCHEMBL24805405 0.81 C3AR1 (0.48) C3AR1MEN1KMT2AGAAFOLH1

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-11596693-B2 Antibody-drug conjugates and uses thereof MABPLEX INTERNATIONAL CO., LTD (CN) 2023-03-07 — — 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-11596693-B2 Antibody-drug conjugates and uses thereof DARS1, CD2, FCGR2A C3AR1 1418/4885MEN1 4125/4885KMT2A 2948/4885

“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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