SCHEMBL3017845

SCHEMBL3017845

O=S(=O)(c1cccc(Cl)c1)N1CCN(c2nc(Cc3ccc(Cl)cc3Cl)cs2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
GBA1 P04062 2/20 0.46
HSD11B1 P28845 1/20 0.45
CHRM4 P08173 1/20 0.44
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.43
PIK3CA P42336 1/20 0.43
MTOR P42345 1/20 0.43
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 2/20 0.41
PKM P14618 2/20 0.41
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PTPN11 Q06124 1/20 0.40
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL3001204 0.92 GBA1 (0.43) ALDH1A1MEN1KMT2AGBA1HSD11B1
SCHEMBL3006402 0.92 ALDH1A1 (0.45) ALDH1A1MEN1KMT2AGBA1LMNA
SCHEMBL3004828 0.92 POLB (0.44) ALDH1A1MEN1KMT2AGBA1LMNA
SCHEMBL3002640 0.91 POLB (0.52) ALDH1A1KMT2AGBA1HSD11B1LMNA
SCHEMBL3018692 0.90 ALDH1A1 (0.48) ALDH1A1MEN1KMT2AGBA1HSD11B1
SCHEMBL3008163 0.90 POLB (0.45) ALDH1A1MEN1KMT2AGBA1HSD11B1
SCHEMBL3006111 0.90 HTT (0.50) ALDH1A1GBA1HSD11B1LMNAPOLB
SCHEMBL3014584 0.89 MAPT (0.48) ALDH1A1MEN1KMT2AGBA1LMNA
SCHEMBL3016091 0.88 TSHR (0.48) ALDH1A1MEN1KMT2AGBA1HSD11B1
SCHEMBL3012544 0.88 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AGBA1LMNA

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
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

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 ALDH1A1 3510/4885MEN1 454/4885KMT2A 2680/4885

“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.