SCHEMBL20981925

SCHEMBL20981925

CC(NC(=O)C(N)=O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.50
MME P08473 2/20 0.39
RAB9A P51151 1/20 0.39
ACE P12821 1/20 0.39
CPA1 P15085 1/20 0.39
ACE2 Q9BYF1 1/20 0.39
CA2 P00918 4/20 0.38
CA1 P00915 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35
SLC7A5 Q01650 1/20 0.35
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 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
SCHEMBL2792653 0.79
SCHEMBL594483 0.79
SCHEMBL814779 0.79 MME (0.42) MMERAB9AACECPA1ACE2
SCHEMBL6546062 0.79 MME (0.42) MMERAB9AACECPA1ACE2
SCHEMBL594482 0.79
SCHEMBL43483 0.79 MME (0.42) MMERAB9AACECPA1ACE2
SCHEMBL3508862 0.77 MME (0.41) MMERAB9AACECPA1ACE2
Hydrazine SCHEMBL27924753 0.77 RAB9A (0.41) MMERAB9AACECPA1ACE2
SCHEMBL28262449 0.77 MME (0.41) MMERAB9AACECPA1ACE2
SCHEMBL596422 0.77 MME (0.41) MMERAB9AACECPA1ACE2

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-3037417-B1 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2019-05-22 EP disclosed