SCHEMBL3013165

SCHEMBL3013165

COc1cc(Cc2csc(N3CCN(S(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)n2)cc(OC)c1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.47
POLB P06746 1/20 0.47
GAA P10253 3/20 0.46
HSD11B1 P28845 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GBA1 P04062 2/20 0.44
HSD17B10 Q99714 2/20 0.44
MAPT P10636 2/20 0.44
USP2 O75604 1/20 0.44
RECQL P46063 1/20 0.44
LMNA P02545 2/20 0.43
TSHR P16473 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41
PKLR P30613 1/20 0.41
ADORA2A P29274 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
SCHEMBL3008919 0.92 HTT (0.47) HTTPOLBGAAHSD11B1KDM4E
SCHEMBL3009774 0.90 MAPT (0.49) HTTPOLBGAAHSD11B1KDM4E
SCHEMBL3646569 0.89 MAPT (0.44) HTTPOLBGAAHSD11B1KDM4E
SCHEMBL3007926 0.89 MEN1 (0.53) HTTPOLBKDM4EGBA1HSD17B10
SCHEMBL3002340 0.88 L3MBTL1 (0.50) HTTPOLBGAAHSD11B1KDM4E
SCHEMBL3014141 0.87 GAA (0.51) HTTPOLBGAAHSD11B1KDM4E
SCHEMBL3011882 0.87 MAPT (0.52) HTTPOLBGAAHSD11B1KDM4E
SCHEMBL3019397 0.87 USP2 (0.45) HTTPOLBHSD11B1GBA1HSD17B10
SCHEMBL3016767 0.87 USP2 (0.43) HTTPOLBKDM4EGBA1HSD17B10
SCHEMBL3007146 0.87 POLB (0.52) HTTPOLBGAAHSD11B1KDM4E

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 HTT 2/4885POLB 4649/4885GAA 110/4885

“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.