SCHEMBL23777960

SCHEMBL23777960

CC(C)(C)CC(N)C(=O)S

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.40
▸ PTGS1 P23219 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SLC7A11 Q9UPY5 1/20 0.33
▸ FDPS P14324 1/20 0.32
▸ GRIK1 P39086 1/20 0.31
▸ ENPEP Q07075 2/20 0.31
▸ SLC7A5 Q01650 1/20 0.31
▸ ALOX15 P16050 1/20 0.30
▸ BLM P54132 1/20 0.30
▸ PMP22 Q01453 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL16388532 0.77 DPP4 (0.41) DPP4PTGS1ALDH1A1MAPTGRIK1
SCHEMBL197117 0.77 SLC7A5 (0.48) DPP4PTGS1ALDH1A1MAPTSLC7A11
SCHEMBL196695 0.77 SLC7A5 (0.48) DPP4PTGS1ALDH1A1MAPTSLC7A11
SCHEMBL15247971 0.77 DPP4 (0.41) DPP4PTGS1ALDH1A1MAPTGRIK1
SCHEMBL12782323 0.77 DPP4 (0.41) DPP4PTGS1ALDH1A1MAPTGRIK1
SCHEMBL15086350 0.77 DPP4 (0.41) DPP4PTGS1ALDH1A1MAPTGRIK1
SCHEMBL8253827 0.77 DPP4 (0.41) DPP4PTGS1ALDH1A1MAPTGRIK1
SCHEMBL15190002 0.77 DPP4 (0.41) DPP4PTGS1ALDH1A1MAPTGRIK1
SCHEMBL197139 0.77 SLC7A5 (0.48) DPP4PTGS1ALDH1A1MAPTSLC7A11
SCHEMBL16017774 0.75 DPP4 (0.40) DPP4PTGS1ALDH1A1MAPTGRIK1

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
EP-3875590-A1 METHOD FOR PRODUCING ORGANIC COMPOUND AND CORYNEFORM BACTERIUM Green Earth Institute Co., Ltd. (JP) 2021-09-08 — — EP disclosed
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