SCHEMBL23323746

SCHEMBL23323746

CN[C@@H](CC(C)C)C(=O)O[C@H](Cc1ccc(N2CCOCC2)cc1)C(=O)OI

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.45
CTSK P43235 3/20 0.45
ACACB O00763 1/20 0.44
ALDH1A1 P00352 4/20 0.42
CTSS P25774 2/20 0.40
CTSB P07858 1/20 0.40
MAPT P10636 6/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SYK P43405 1/20 0.38
TSHR P16473 1/20 0.37
CDK2 P24941 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL20979803 0.90 CTSL (0.48) CTSLCTSKACACBALDH1A1CTSS
SCHEMBL23323811 0.81 MME (0.44)
SCHEMBL20979758 0.80 CTSL (0.41) CTSLCTSKACACBALDH1A1CTSS
SCHEMBL20979761 0.80 CTSL (0.39) CTSLCTSKACACBALDH1A1CTSS
SCHEMBL23323960 0.78 CTSL (0.40) CTSLCTSKACACBALDH1A1CTSS
SCHEMBL23295228 0.78 CTSL (0.40) CTSLCTSKACACBALDH1A1CTSS
SCHEMBL20979888 0.78 CTSL (0.40) CTSLCTSKACACBALDH1A1CTSS
SCHEMBL20979763 0.77 CTSL (0.37) CTSLCTSKACACBALDH1A1CTSS
SCHEMBL19066747 0.75 CTSL (0.39) CTSLCTSKACACBALDH1A1
SCHEMBL28772175 0.75 CTSL (0.39) CTSLCTSKACACBALDH1A1

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-20210130315-A1 METHOD FOR THE SYNTHESIS OF CYCLIC DEPSIPEPTIDES BAYER ANIMAL HEALTH GMBH (DE) 2021-05-06 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-20210130315-A1 METHOD FOR THE SYNTHESIS OF CYCLIC DEPSIPEPTIDES DNPEP, NPEPPS, PREP CTSL 799/4885CTSK 669/4885ACACB 2067/4885

“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.