SCHEMBL20033772

SCHEMBL20033772

O=COCC[C@@H](O)[C@H](O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
ALDH1A1 P00352 3/20 0.37
AOC3 Q16853 3/20 0.37
KDM4E B2RXH2 3/20 0.36
LMNA P02545 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2C P18825 1/20 0.36
HIF1A Q16665 1/20 0.36
CYP2D6 P10635 1/20 0.35
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
CHRM2 P08172 1/20 0.34
ADRA1A P35348 1/20 0.34

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
SCHEMBL19669395 1.00 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3ALDH1A1AOC3
SCHEMBL27995093 0.82 KDM4E (0.47) ALDH1A1AOC3KDM4ELMNAL3MBTL1
SCHEMBL5859438 0.80 HRH1 (0.45) SLC6A2SLC6A4SLC6A3ALDH1A1LMNA
SCHEMBL19669375 0.78 EPHX1 (0.40) KMT2A
SCHEMBL19669376 0.78 EPHX1 (0.40) KMT2A
SCHEMBL19669393 0.78 CASP1 (0.37) SLC6A2SLC6A4SLC6A3AOC3KDM4E
SCHEMBL19669399 0.78 CASP1 (0.37) SLC6A2SLC6A4SLC6A3AOC3KDM4E
SCHEMBL9572888 0.75 RIPK1 (0.47) ALDH1A1AOC3
SCHEMBL9572986 0.72 CCR5 (0.40) ALDH1A1LMNACYP2D6KMT2ACHRM2
SCHEMBL28852143 0.71 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3ALDH1A1AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220218702-A1 SULFAMATE DERIVATIVE COMPOUNDS FOR USE IN TREATING OR ALLEVIATING A PSYCHIATRIC DISORDER BIO-PHARM SOLUTIONS CO., LTD. (KR) 2022-07-14 US disclosed
US-9937145-B2 Sulfamate derivative compound for use in preventing or treating epilepsy BIO-PHARM SOLUTIONS CO., LTD. (KR) 2018-04-10 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-20220218702-A1 SULFAMATE DERIVATIVE COMPOUNDS FOR USE IN TREATING OR ALLEVIATING A PSYCHIATRIC DISORDER SLC6A4, SLC6A3, SLC6A2 SLC6A2 3/4885SLC6A4 1/4885SLC6A3 2/4885

“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.