SCHEMBL20694366

SCHEMBL20694366

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

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 1/20 0.39
LTA4H P09960 2/20 0.36
MME P08473 3/20 0.36
ACE P12821 3/20 0.34
BMP1 P13497 2/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CPA1 P15085 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
ALDH1A1 P00352 1/20 0.32
FNTA P49354 2/20 0.31
FNTB P49356 2/20 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
SCHEMBL27267642 0.85 GNPAT (0.44) GNPATMMEACEBMP1CA2
SCHEMBL10036415 0.84 ECE1 (0.41)
SCHEMBL10036293 0.84 ECE1 (0.41)
SCHEMBL27267745 0.83 GNPAT (0.46) GNPATMMEBMP1CA2CA4
SCHEMBL13377669 0.83 GNPAT (0.46) GNPATMMEBMP1CA2CA4
SCHEMBL24239570 0.82 BIRC2 (0.41) LTA4HMME
SCHEMBL25602934 0.82 FOLH1 (0.43) BMP1
SCHEMBL25602938 0.82 FOLH1 (0.43) BMP1
SCHEMBL25602931 0.82 FOLH1 (0.43) BMP1
SCHEMBL25602936 0.82 FOLH1 (0.43) BMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020132588-A1 COMBINATION THERAPY OF ARMS AND NATURAL KILLER CELLS KLEO PHARMACEUTICALS, INC. (US) 2020-06-25 WO disclosed
WO-2019023501-A1 UNIVERSAL ABT COMPOUNDS AND USES THEREOF KLEO PHARMACEUTICALS, INC. (US) 2019-01-31 WO disclosed