SCHEMBL3688998

SCHEMBL3688998

C=CN(CC(=O)O)CC(=O)O.O=C(O)CNCC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC4 O15439 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 2/20 0.32
EYA2 O00167 1/20 0.32
APP P05067 1/20 0.32
ACE P12821 1/20 0.32
ALOX15 P16050 2/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CHRM2 P08172 1/20 0.31
ADRA2A P08913 1/20 0.31
TSHR P16473 1/20 0.31
DRD1 P21728 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
CYP2C19 P33261 1/20 0.31
ADRA1A P35348 1/20 0.31
DRD3 P35462 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 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
Edetic Acid SCHEMBL1899790 0.91 TDP1 (0.50) TDP1EYA2APPACEALOX15
SCHEMBL19206931 0.87 TDP1 (0.31) TDP1EYA2APPACEALOX15
SCHEMBL3806335 0.86 TDP1 (0.41) ABCC4MAPTTDP1EYA2APP
SCHEMBL8768371 0.81
SCHEMBL19664261 0.76 ABCC4 (0.42) ABCC4MAPTTDP1ALOX15KDM4E
Nitrilotriacetic Acid SCHEMBL6646334 0.74 TDP1 (0.52) TDP1EYA2APPACEALOX15
SCHEMBL28032511 0.73
Formaldehyde SCHEMBL6118438 0.72 LMNA (0.44) ABCC4MAPTKDM4ELMNATSHR
SCHEMBL4816014 0.72 LMNA (0.50) MAPTTDP1KDM4ELMNATSHR
SCHEMBL27023 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4313144-A1 COMBINATIONS COMPRISING ANTI-TM4SF1 ANTIBODIES AND IMMUNOTHERAPEUTIC AGENTS AND METHODS OF USING THE SAME Angiex, Inc. (US) 2024-02-07 EP disclosed
WO-2022204565-A1 COMBINATIONS COMPRISING ANTI-TM4SF1 ANTIBODIES AND IMMUNOTHERAPEUTIC AGENTS AND METHODS OF USING THE SAME ANGIEX, INC. (US) 2022-09-29 WO disclosed
WO-2010017047-A1 THERAPEUTIC COMPOUNDS MERCK & CO., INC. (US) 2010-02-11 WO disclosed
EP-1974949-B1 Heat-sensitive transfer image-receiving sheet and production method thereof FUJIFILM CORP (JP) 2009-11-18 EP disclosed
EP-1974949-A1 Heat-sensitive transfer image-receiving sheet and production method thereof FUJIFILM Corporation (JP) 2008-10-01 EP disclosed