SCHEMBL5580195

SCHEMBL5580195

CC(CCC(N)C(=O)O)CC(N)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BHMT Q93088 2/20 0.56
BHMT2 Q9H2M3 1/20 0.56
KMT2A Q03164 2/20 0.54
PMP22 Q01453 2/20 0.54
ALOX15 P16050 1/20 0.54
BLM P54132 1/20 0.54
GSR P00390 2/20 0.45
CYP1A2 P05177 2/20 0.45
SLC7A5 Q01650 1/20 0.45
GRM8 O00222 1/20 0.45
GRM6 O15303 1/20 0.45
GRIN2D O15399 1/20 0.45
GRIN3B O60391 1/20 0.45
GRIK1 P39086 1/20 0.45
GRM5 P41594 1/20 0.45
GRIA1 P42261 1/20 0.45
GRIA2 P42262 1/20 0.45
GRIA3 P42263 1/20 0.45
SLC1A3 P43003 1/20 0.45
SLC1A2 P43004 1/20 0.45

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
SCHEMBL5322808 0.81 SLC7A5 (0.58) BHMTKMT2APMP22ALOX15BLM
SCHEMBL6663362 0.81 SLC7A5 (0.58) BHMTKMT2APMP22ALOX15BLM
SCHEMBL14445570 0.80 BHMT (0.48) BHMTCYP1A2
SCHEMBL5034721 0.78 BHMT (0.60) BHMTBHMT2KMT2APMP22ALOX15
SCHEMBL2417361 0.78 BHMT (0.60) BHMTBHMT2KMT2APMP22ALOX15
SCHEMBL1666990 0.78 BHMT (0.60) BHMTBHMT2KMT2APMP22ALOX15
SCHEMBL16574737 0.78 BHMT (0.60) BHMTBHMT2KMT2APMP22ALOX15
SCHEMBL1199780 0.78 BHMT (0.60) BHMTBHMT2KMT2APMP22ALOX15
SCHEMBL7071560 0.78 SLC1A3 (0.38) BHMTBHMT2BLMSLC1A3SLC1A2
SCHEMBL19368040 0.78 SLC1A3 (0.38) BHMTBHMT2BLMSLC1A3SLC1A2

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-20070258899-A1 Diagnostic and therapeutic agents KARYON-CTT LTD (FI) 2007-11-08 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-20070258899-A1 Diagnostic and therapeutic agents YBX1, MLX, TPX2 BHMT 4764/4885BHMT2 4817/4885KMT2A 3586/4885

“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.