SCHEMBL21965275

SCHEMBL21965275

CN[C@H](C(=O)N[C@H](CCCCNC(N)=O)C(=O)Nc1ccc(CO)cc1)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 3/20 0.41
▸ SIRT1 Q96EB6 8/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ SPHK1 Q9NYA1 1/20 0.39
▸ SIRT2 Q8IXJ6 8/20 0.38
▸ SIRT3 Q9NTG7 3/20 0.38
▸ SIRT5 Q9NXA8 2/20 0.38

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
SCHEMBL20206643 0.97 FURIN (0.42) FURINSIRT1HTTSMN1; SMN2SPHK1
SCHEMBL24728301 0.97 FURIN (0.42) FURINSIRT1HTTSMN1; SMN2SPHK1
SCHEMBL14234316 0.97 FURIN (0.42) FURINSIRT1HTTSMN1; SMN2SPHK1
SCHEMBL27291528 0.89 FURIN (0.49) FURINSIRT1HTTSMN1; SMN2SPHK1
SCHEMBL17133812 0.88 FURIN (0.45) FURINSIRT1HTTSMN1; SMN2SIRT2
SCHEMBL21122921 0.88 FURIN (0.41) FURINSIRT1HTTSMN1; SMN2
SCHEMBL17133811 0.88 FURIN (0.45) FURINSIRT1HTTSMN1; SMN2SIRT2
SCHEMBL16847753 0.88 FURIN (0.43) FURINSIRT1HTTSMN1; SMN2SIRT2
SCHEMBL24414345 0.88 FURIN (0.41) FURINSIRT1HTTSMN1; SMN2SPHK1
SCHEMBL21566843 0.88 SIRT1 (0.41) SIRT1SPHK1SIRT2SIRT3SIRT5

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-20200138968-A1 PROCESS FOR PREPARING INTERMEDIATE OF ANTIBODY DRUG CONJUGATE REMEGEN, LTD. (CN) 2020-05-07 — — 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-20200138968-A1 PROCESS FOR PREPARING INTERMEDIATE OF ANTIBODY DRUG CONJUGATE MMAB, BTD, MGAM FURIN 2094/4885SIRT1 3471/4885HTT 2638/4885

“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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