SCHEMBL8633167

SCHEMBL8633167

CCOC(=O)[C@@](CCC1CCCCN1)(OC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 6/20 0.43
SLC6A2 P23975 4/20 0.43
SLC6A4 P31645 3/20 0.43
KMT2A Q03164 2/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.36
CACNA2D1 P54289 1/20 0.35
CACNA1B Q00975 1/20 0.35
CACNB1 Q02641 1/20 0.35
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
DHFR P00374 1/20 0.35
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
LTA4H P09960 1/20 0.34
MEN1 O00255 1/20 0.34
ATM Q13315 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
SCHEMBL8633173 1.00 SLC6A3 (0.43) SLC6A3SLC6A2SLC6A4KMT2ALMNA
SCHEMBL8629578 0.86 CHRNB4 (0.37) KMT2A
SCHEMBL8629579 0.86 CHRNB4 (0.37) KMT2A
SCHEMBL8633608 0.86 CHRNB4 (0.37) KMT2A
SCHEMBL8630074 0.84 MAPT (0.39) LMNAPOLBITGB3ITGA2B
SCHEMBL8630070 0.84 MAPT (0.39) LMNAPOLBITGB3ITGA2B
SCHEMBL8629719 0.75 BCHE (0.49) KMT2AATM
SCHEMBL8629722 0.75 BCHE (0.49) KMT2AATM
SCHEMBL8630445 0.74 SLC6A2 (0.38) SLC6A3SLC6A2SLC6A4KMT2ALMNA
SCHEMBL8630448 0.74 SLC6A2 (0.38) SLC6A3SLC6A2SLC6A4KMT2ALMNA

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
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
WO-1994010127-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE' FARMACEUTICI S.P.A. (IT) 1994-05-11 WO disclosed