SCHEMBL355795

SCHEMBL355795

CC[C@H](Cl)C(=O)CC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.38
SRR Q9GZT4 1/20 0.38
FFAR3 O14843 2/20 0.36
CYP2C9 P11712 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
MME P08473 1/20 0.31
ACE P12821 1/20 0.31
CPA1 P15085 1/20 0.31
ACE2 Q9BYF1 1/20 0.31
TSHR P16473 2/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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
SCHEMBL357107 1.00 LDHA (0.38) LDHASRRFFAR3CYP2C9HDAC3
SCHEMBL30532234 0.88 TSHR (0.33) TSHR
SCHEMBL10777977 0.81 HDAC1 (0.41) LDHASRRFFAR3HDAC3HDAC1
SCHEMBL29411100 0.78 GAA (0.41) LMNAEGLN1
SCHEMBL10780876 0.78 CA2 (0.42) ACE2TSHR
SCHEMBL29199347 0.77 LDHA (0.40) LDHASRRCYP2C9TSHRLMNA
SCHEMBL10031543 0.76
SCHEMBL16445585 0.74 GPR84 (0.48) ACE2TSHR
SCHEMBL2021291 0.74 USP2 (0.44) LDHASRRFFAR3HDAC3HDAC1
SCHEMBL3838841 0.74

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-2569275-A1 A PROCESS FOR THE HYDROGENATION OF KETOESTERS Lonza Ltd. (CH) 2013-03-20 EP claimed
US-20120016153-A1 PROCESS FOR THE HYDROGENATION OF KETOESTERS LONZA LTD (CH) 2012-01-19 US claimed
WO-2011141160-A1 A PROCESS FOR THE HYDROGENATION OF KETOESTERS LONZA LTD (CH) 2011-11-17 WO claimed
EP-2386536-A1 A process for the hydrogenation of ketoesters Lonza Ltd. (CH) 2011-11-16 EP claimed
US-8037666-B2 Mower with an lightening device including torsion bars KUHN S.A. (FR) 2011-10-18 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120016153-A1 PROCESS FOR THE HYDROGENATION OF KETOESTERS CBR3, BCKDK, PAOX LDHA 222/4885SRR 557/4885FFAR3 308/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.