SCHEMBL8633608

SCHEMBL8633608

COC(=O)[C@@](CCC1CCCN1)(OC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
GHSR Q92847 4/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL8629578 1.00 CHRNB4 (0.37) CHRNB4CHRNA3GHSRKMT2ATSHR
SCHEMBL8629579 1.00 CHRNB4 (0.37) CHRNB4CHRNA3GHSRKMT2ATSHR
SCHEMBL8633173 0.86 SLC6A3 (0.43) KMT2A
SCHEMBL8633167 0.86 SLC6A3 (0.43) KMT2A
SCHEMBL8633831 0.74 MEN1 (0.42) KMT2A
SCHEMBL8636664 0.74 MEN1 (0.42) KMT2A
SCHEMBL8630070 0.73 MAPT (0.39)
SCHEMBL8630074 0.73 MAPT (0.39)
SCHEMBL8636632 0.72 FDPS (0.34) CHRNB4CHRNA3GHSRKMT2A
SCHEMBL8630472 0.72 FDPS (0.34) CHRNB4CHRNA3GHSRKMT2A

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