SCHEMBL8632541

SCHEMBL8632541

CCOC(=O)C(CC[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.43
PDE8B O95263 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
FKBP1A P62942 2/20 0.38
HSD17B10 Q99714 1/20 0.38
KDM1A O60341 1/20 0.38
POLB P06746 1/20 0.37
CHEK2 O96017 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL8632538 1.00 ATM (0.43) ATMPDE8BMEN1KMT2AFKBP1A
SCHEMBL9210070 0.95 ATM (0.44) ATMPDE8BMEN1KMT2AFKBP1A
SCHEMBL5940127 0.88 ATM (0.43) ATMPDE8BMEN1KMT2AFKBP1A
SCHEMBL8630832 0.86 SMN1; SMN2 (0.42) ATMMEN1KMT2AHSD17B10KDM1A
SCHEMBL8634312 0.86 SMN1; SMN2 (0.42) ATMMEN1KMT2AHSD17B10KDM1A
SCHEMBL8630831 0.86 SMN1; SMN2 (0.42) ATMMEN1KMT2AHSD17B10KDM1A
SCHEMBL8634310 0.86 SMN1; SMN2 (0.42) ATMMEN1KMT2AHSD17B10KDM1A
SCHEMBL5940343 0.83 ATM (0.43) ATMPDE8BMEN1KMT2AHSD17B10
SCHEMBL13996061 0.81 ATM (0.46) ATMPDE8BKMT2AHSD17B10KDM1A
SCHEMBL24739379 0.81 ATM (0.48) ATMPDE8BMEN1KMT2AFKBP1A

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 4 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
WO-1994010127-A1 TARTRONIC ACIDS, THEIR ACETALIC ETHERS AND O-ESTERS DOMPE' FARMACEUTICI S.P.A. (IT) 1994-05-11 WO disclosed