SCHEMBL23656867

SCHEMBL23656867

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.44
▸ ANPEP P15144 6/20 0.43
▸ LAP3 P28838 5/20 0.43
▸ ERAP1 Q9NZ08 1/20 0.43
▸ SLC1A3 P43003 1/20 0.39
▸ SLC1A2 P43004 1/20 0.39
▸ CYP19A1 P11511 1/20 0.38
▸ TSHR P16473 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ RNPEP Q9H4A4 3/20 0.34
▸ CACNA2D1 P54289 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ CACNB3 P54284 1/20 0.34
▸ CACNA1C Q13936 1/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ CHRM4 P08173 1/20 0.34
▸ CHRM5 P08912 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ CHRM3 P20309 1/20 0.34

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
SCHEMBL17662348 1.00 SLC7A5 (0.44) SLC7A5ANPEPLAP3ERAP1SLC1A3
SCHEMBL26498423 0.85 CYP19A1 (0.40) SLC7A5ANPEPLAP3ERAP1SLC1A3
SCHEMBL21985604 0.83 SLC1A3 (0.31) SLC7A5LAP3SLC1A3SLC1A2TSHR
SCHEMBL19361332 0.82 SLC7A5 (0.41) SLC7A5ANPEPLAP3ERAP1SLC1A3
SCHEMBL15574890 0.81 MAPT (0.41) LAP3SLC1A3SLC1A2TSHRALDH1A1
SCHEMBL14887474 0.81 MAPT (0.41) LAP3SLC1A3SLC1A2TSHRALDH1A1
SCHEMBL14989440 0.81 MAPT (0.41) LAP3SLC1A3SLC1A2TSHRALDH1A1
SCHEMBL14887353 0.81 MAPT (0.41) LAP3SLC1A3SLC1A2TSHRALDH1A1
SCHEMBL14989441 0.81 MAPT (0.41) LAP3SLC1A3SLC1A2TSHRALDH1A1
SCHEMBL18274692 0.81 ALDH1A1 (0.35) SLC7A5TSHRALDH1A1CACNA2D1LMNA

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-20210220477-A1 SITE SPECIFIC ANTIBODY-DRUG CONJUGATES WITH PEPTIDE-CONTAINING LINKERS MERSANA THERAPEUTICS, INC. 2021-07-22 — — 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-20210220477-A1 SITE SPECIFIC ANTIBODY-DRUG CONJUGATES WITH PEPTIDE-CONTAINING LINKERS CD2BP2, DNPEP, LNPEP SLC7A5 1253/4885ANPEP 20/4885LAP3 199/4885

“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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