SCHEMBL3019232

SCHEMBL3019232

O=[N+]([O-])c1cc(S(=O)(=O)N2CCN(c3nc(-c4ccc(Cl)cc4Cl)cs3)CC2)ccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.54
VCAM1 P19320 3/20 0.52
NPBWR1 P48145 1/20 0.51
MCHR1 Q99705 1/20 0.51
SMN1; SMN2 Q16637 4/20 0.48
ALDH1A1 P00352 4/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MAPT P10636 6/20 0.46
POLB P06746 2/20 0.44
EIF4E P06730 1/20 0.42
USP2 O75604 1/20 0.42
RECQL P46063 1/20 0.42
HSD17B10 Q99714 1/20 0.42
THRB P10828 1/20 0.42
CYP17A1 P05093 1/20 0.41
CYP21A2 P08686 1/20 0.41
CYP11B1 P15538 1/20 0.41
KMT2A Q03164 5/20 0.41
LMNA P02545 3/20 0.41
MEN1 O00255 3/20 0.41

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
SCHEMBL3007723 0.89 MAPT (0.57) ARSMN1; SMN2ALDH1A1L3MBTL1MAPT
SCHEMBL3001171 0.89 SMN1; SMN2 (0.60) VCAM1NPBWR1MCHR1SMN1; SMN2ALDH1A1
SCHEMBL2997717 0.88 AR (0.60) ARSMN1; SMN2ALDH1A1L3MBTL1MAPT
SCHEMBL3008900 0.87 AR (0.53) ARSMN1; SMN2ALDH1A1L3MBTL1MAPT
SCHEMBL3006931 0.87 AR (0.64) ARSMN1; SMN2ALDH1A1L3MBTL1MAPT
SCHEMBL3013968 0.87 SMN1; SMN2 (0.54) ARVCAM1NPBWR1MCHR1SMN1; SMN2
SCHEMBL3016510 0.85 VCAM1 (0.53) VCAM1NPBWR1MCHR1SMN1; SMN2ALDH1A1
SCHEMBL3001871 0.85 SMN1; SMN2 (0.57) ARVCAM1NPBWR1MCHR1SMN1; SMN2
SCHEMBL3011715 0.85 MEN1 (0.57) ARVCAM1NPBWR1MCHR1SMN1; SMN2
SCHEMBL3021769 0.84 AR (0.53) ARVCAM1NPBWR1MCHR1SMN1; SMN2

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-2188272-B1 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES REMYND NV (BE) 2016-02-24 EP disclosed
US-8722681-B2 N-sulfonyl thiazolylpiperazine derivatives and related N-sulfonyl heterocyclic derivatives for the treatment of neuro degenerative diseases NV REMYND (BE) 2014-05-13 US disclosed
US-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES NV REMYND (BE) 2010-08-05 US disclosed
EP-2188272-A2 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV Remynd (BE) 2010-05-26 EP disclosed
WO-2009019295-A2 PHENYL- AND BENZYLTHIAZOLYLPIPERAZINE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-12 WO 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-20100197703-A1 N-SULFONYL THIAZOLYLPIPERAZINE DERIVATIVES AND RELATED N-SULFONYL HETEROCYCLIC DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES SMN1; SMN2, HTT, SNCA AR 3801/4885VCAM1 3154/4885NPBWR1 782/4885

“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.