SCHEMBL11441237

SCHEMBL11441237

C=CC(O)[C@@H]1CCC[C@H]1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 3/20 0.37
SLC1A1 P43005 2/20 0.37
PEPD P12955 1/20 0.36
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ACE P12821 1/20 0.33
BLM P54132 1/20 0.33
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
GRM8 O00222 1/20 0.31
GRM6 O15303 1/20 0.31
LMNA P02545 1/20 0.31
APEX1 P27695 1/20 0.31
GRM5 P41594 1/20 0.31
PMP22 Q01453 1/20 0.31
GRM1 Q13255 1/20 0.31
GRM2 Q14416 1/20 0.31
GRM3 Q14832 1/20 0.31
GRM4 Q14833 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL11441235 1.00 SLC1A2 (0.37) SLC1A2SLC1A1PEPDMEN1KMT2A
SCHEMBL11441239 1.00 SLC1A2 (0.37) SLC1A2SLC1A1PEPDMEN1KMT2A
SCHEMBL23481696 0.77 SLC1A2 (0.43) SLC1A2SLC1A1PEPDMEN1KMT2A
SCHEMBL7063103 0.73 F2 (0.35)
SCHEMBL17628741 0.71 ACE (0.44) SLC1A2SLC1A1PEPDMEN1KMT2A
SCHEMBL10289797 0.71 ACE (0.44) SLC1A2SLC1A1PEPDMEN1KMT2A
SCHEMBL11447906 0.71 SLC1A2 (0.42) SLC1A2SLC1A1PEPDMEN1KMT2A
SCHEMBL14072902 0.71 ACE (0.44) SLC1A2SLC1A1PEPDMEN1KMT2A
SCHEMBL11447904 0.71 SLC1A2 (0.42) SLC1A2SLC1A1PEPDMEN1KMT2A
SCHEMBL14473782 0.71 ACE (0.44) SLC1A2SLC1A1PEPDMEN1KMT2A

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
US-4206137-A Thioalkanoylalkanoic acid compounds E. R. SQUIBB & SONS, INC. (US) 1980-06-03 US disclosed