SCHEMBL8713404

SCHEMBL8713404

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nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 4/20 0.41
LAP3 P28838 3/20 0.41
ERAP1 Q9NZ08 1/20 0.41
FDPS P14324 3/20 0.39
ALDH1A1 P00352 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
METAP1 P53582 2/20 0.37
TRPM8 Q7Z2W7 1/20 0.34
GABBR2 O75899 1/20 0.34
GABBR1 Q9UBS5 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
SCHEMBL8713410 1.00 ANPEP (0.41) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL28342575 0.78 FDPS (0.34) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL26310696 0.76 ANPEP (0.42) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL8933408 0.76
SCHEMBL4536812 0.76
SCHEMBL5745180 0.76 LAP3 (0.54) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL5745177 0.76 LAP3 (0.54) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL12570893 0.76 FDPS (0.59) ANPEPLAP3ERAP1FDPSALDH1A1
SCHEMBL701768 0.72
SCHEMBL601976 0.72

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871454-A4 1998-11-25 EP disclosed
EP-0871454-A1 PHOSPHOROUS-CONTAINING CYSTEINE AND SERINE PROTEASE INHIBITORS CEPHALON, INC. (US) 1998-10-21 EP disclosed
WO-1997003679-A1 PHOSPHOROUS-CONTAINING CYSTEINE AND SERINE PROTEASE INHIBITORS CEPHALON, INC. (US) 1997-02-06 WO disclosed