SCHEMBL10370366

SCHEMBL10370366

C[C@H](C[S])NC(=O)[C@@H](N)CCC(N)=O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 9/20 0.61
DPP9 Q86TI2 9/20 0.61
DPP4 P27487 6/20 0.61
BLM P54132 2/20 0.46
ALOX15 P16050 1/20 0.46
PMP22 Q01453 1/20 0.46
KMT2A Q03164 1/20 0.46
DPP7 Q9UHL4 8/20 0.35
SLC15A1 P46059 1/20 0.34
TLR2 O60603 1/20 0.32
RRM1 P23921 1/20 0.32
NOD1 Q9Y239 1/20 0.32
BMP1 P13497 1/20 0.31
CTSD P07339 1/20 0.31
BACE1 P56817 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL10370581 0.86 DPP4 (0.61) DPP8DPP9DPP4BLMCTSD
SCHEMBL10369890 0.82 DPP4 (0.40) DPP8DPP9DPP4DPP7
SCHEMBL7762244 0.82 DPP8 (0.69) DPP8DPP9DPP4BLMALOX15
SCHEMBL10940865 0.82 DPP8 (0.69) DPP8DPP9DPP4BLMALOX15
SCHEMBL30799779 0.79 DPP8 (0.65) DPP8DPP9DPP4BLMALOX15
SCHEMBL751144 0.77 DPP4 (0.63) DPP8DPP9DPP4BLMALOX15
SCHEMBL3065655 0.77 DPP4 (0.63) DPP8DPP9DPP4BLMALOX15
Hydrochloric Acid SCHEMBL23404089 0.76 DPP4 (0.61) DPP8DPP9DPP4BLMALOX15
SCHEMBL7947817 0.76 DPP8 (0.61) DPP8DPP9DPP4BLMALOX15
SCHEMBL7947818 0.76 DPP8 (0.61) DPP8DPP9DPP4BLMALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0163550-B1 MITOMYCIN DERIVATIVES, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1990-11-22 EP claimed
EP-0163550-A2 Mitomycin derivatives, preparation thereof and pharmaceutical compositions containing them KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1985-12-04 EP claimed
EP-0163550-B1 MITOMYCIN DERIVATIVES, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1990-11-22 EP disclosed
US-4691024-A BACTERICIDES, ANTITUMOR KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1987-09-01 US disclosed