SCHEMBL5928512

SCHEMBL5928512

CS(=O)(=O)NC(O)(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.45
SRC P12931 1/20 0.45
KMT2A Q03164 1/20 0.41
PTGS2 P35354 2/20 0.40
NR3C2 P08235 2/20 0.39
KCNN4 O15554 1/20 0.37
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
KEAP1 Q14145 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 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
SCHEMBL5892020 0.81 CES1 (0.46) CES1SRCHTTSMN1; SMN2
SCHEMBL1395461 0.79 CES1 (0.50) CES1SRCKMT2AKCNN4SMN1; SMN2
SCHEMBL754131 0.76 CES1 (0.47) CES1SRCKCNN4SMN1; SMN2ALDH1A1
SCHEMBL5483963 0.75 CES1 (0.46) CES1SRCKMT2AKCNN4SMN1; SMN2
SCHEMBL1252890 0.75 CES1 (0.46) CES1SRCKMT2AKCNN4SMN1; SMN2
SCHEMBL4769359 0.75 KCNN4 (0.48) CES1SRCKMT2AKCNN4HTT
SCHEMBL3631032 0.74 CES1 (0.49) CES1SRCKMT2AKCNN4HTT
SCHEMBL11057570 0.73 CES1 (0.45) CES1SRCKMT2AKCNN4HTT
SCHEMBL6150376 0.73 SRC (0.52) CES1SRCKMT2ANR3C2SMN1; SMN2
SCHEMBL5843722 0.72 ALDH1A1 (0.44) CES1SRCKMT2AKCNN4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060211740-A1 Novel compounds GLAXO GROUP LIMITED 2006-09-21 US disclosed

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-20060211740-A1 Novel compounds BACE2, BACE1, PSEN2 CES1 1417/4885SRC 4533/4885KMT2A 590/4885

“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.