SCHEMBL3018880

SCHEMBL3018880

COc1cc(Cc2csc(N3CCN(S(=O)(=O)c4ccccc4C(F)(F)F)CC3)n2)cc(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 3/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
IDO1 P14902 1/20 0.44
MAPT P10636 2/20 0.43
HSD17B10 Q99714 2/20 0.43
USP2 O75604 1/20 0.43
RECQL P46063 1/20 0.43
GBA1 P04062 2/20 0.43
HSD11B1 P28845 2/20 0.42
ALDH1A1 P00352 2/20 0.41
CHRM4 P08173 1/20 0.41
CNR2 P34972 1/20 0.41
DCTPP1 Q9H773 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
KCNQ1 P51787 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
SCHEMBL3013853 0.93 MAPT (0.48) KMT2AMEN1LMNAALOX15TSHR
SCHEMBL3012189 0.92 KMT2A (0.48) KMT2AMEN1LMNAALOX15TSHR
SCHEMBL3012506 0.90 KMT2A (0.46) KMT2AMEN1LMNAALOX15TSHR
SCHEMBL3649927 0.89 MAPT (0.45) KMT2AMEN1LMNAALOX15TSHR
SCHEMBL3005125 0.88 KMT2A (0.50) KMT2AMEN1LMNAALOX15TSHR
SCHEMBL3021870 0.88 KMT2A (0.46) KMT2AMEN1LMNAALOX15TSHR
SCHEMBL3013459 0.87 KMT2A (0.51) KMT2AMEN1LMNAALOX15TSHR
SCHEMBL3001787 0.87 MAPT (0.44) KMT2AMEN1LMNAALOX15MAPK1
SCHEMBL3016668 0.87 KMT2A (0.55) KMT2AMEN1LMNAALOX15TSHR
SCHEMBL3014362 0.86 MAPT (0.43) KMT2AMEN1LMNAALOX15MAPK1

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 KMT2A 2680/4885MEN1 454/4885LMNA 80/4885

“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.