SCHEMBL5128955

SCHEMBL5128955

O=C(COC1CCCN(S(=O)(=O)c2ccccc2)C1)N1CCC(O)(c2ccccn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
LMNA P02545 4/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 3/20 0.42
PKM P14618 2/20 0.42
HTT P42858 1/20 0.42
CCR6 P51684 1/20 0.42
CYP2C19 P33261 1/20 0.42
THRB P10828 1/20 0.41
ATM Q13315 1/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 2/20 0.41
GAA P10253 2/20 0.40
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL5128337 0.95 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2LMNAHPGDMAPK1
SCHEMBL5128076 0.89 ATM (0.46) ALDH1A1SMN1; SMN2LMNAHPGDKDM4E
SCHEMBL5125291 0.88 GAA (0.43) ALDH1A1LMNAL3MBTL1KDM4EPKM
SCHEMBL5131821 0.84 CCR2 (0.48) SMN1; SMN2LMNAHPGDL3MBTL1GAA
SCHEMBL5128724 0.83 HTR6 (0.38) ALDH1A1LMNAHPGDMAPK1L3MBTL1
SCHEMBL5131323 0.83 HSD17B10 (0.45) ALDH1A1MAPK1L3MBTL1KDM4EHSD17B10
SCHEMBL5128250 0.82 AVPR1A (0.45) ALDH1A1SMN1; SMN2LMNAPKMCYP2C19
SCHEMBL5131253 0.81 CNR1 (0.40) ALDH1A1SMN1; SMN2HPGDKDM4EPKM
SCHEMBL5128940 0.81 EPHX2 (0.40) MAPK1PKM
SCHEMBL5122795 0.80 SLC6A9 (0.42) ALDH1A1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 US claimed
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 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-20080249128-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, NPSR1 ALDH1A1 2737/4885SMN1; SMN2 1001/4885LMNA 1324/4885

“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.