SCHEMBL8634313

SCHEMBL8634313

NCCCC(O)(C(=O)O)C(=O)O.[LiH]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 2/20 0.48
LMNA P02545 3/20 0.45
BLM P54132 3/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
PMP22 Q01453 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
FDPS P14324 4/20 0.43
PDE3A Q14432 1/20 0.43
THRB P10828 2/20 0.40
KMT2A Q03164 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
GABRR3 A8MPY1 1/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
HDAC3 O15379 1/20 0.40
GABBR2 O75899 1/20 0.40
CYP1A2 P05177 1/20 0.40
GABRA1 P14867 1/20 0.40

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
SCHEMBL27390741 0.97 ODC1 (0.50) ODC1LMNABLMKDM4EMAPT
SCHEMBL8633558 0.95 ODC1 (0.48) ODC1LMNABLMKDM4EMAPT
SCHEMBL27537431 0.88 FDPS (0.48) ODC1LMNABLMKDM4EMAPT
SCHEMBL27390746 0.81 LMNA (0.40) ODC1LMNABLMKDM4EMAPT
SCHEMBL5596203 0.77 ODC1 (0.50) ODC1LMNABLMKDM4EMAPT
SCHEMBL721800 0.74 ALDH1A1 (0.41) TSHRCYP2D6ALDH1A1ALOX15
SCHEMBL8633559 0.73 FDPS (0.41) ODC1LMNABLMKDM4EMAPT
Lithium Ion SCHEMBL8634316 0.73 FDPS (0.41) ODC1LMNABLMKDM4EMAPT
SCHEMBL29116696 0.72 ODC1 (0.56) ODC1LMNABLMKDM4EMAPT
SCHEMBL6632838 0.72 ODC1 (0.56) ODC1LMNABLMKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5773465-A Tartronic acids, their acetalic ethers and o-esters DOMPE FARMACEUTICI S.P.A. (IT) 1998-06-30 US disclosed
US-5656656-A Tartronic acids, their acetalic ethers and O-esters DOMPE FARMACEUTICI S.P.A. (IT) 1997-08-12 US disclosed
EP-0667850-B1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE FARMACEUTICI SPA (IT) 1997-05-28 EP disclosed
EP-0667850-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS. DOMPE FARMACEUTICI SPA (IT) 1995-08-23 EP disclosed
CN-1091741-A Tartronic acid and acetal ether thereof and O-ester DOMPE FARMACEUTICI SPA (IT) 1994-09-07 CN disclosed
WO-1994010127-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE' FARMACEUTICI S.P.A. (IT) 1994-05-11 WO disclosed