SCHEMBL3017807

SCHEMBL3017807

COc1ccc(OC)c(S(=O)(=O)N2CCN(c3nc(Cc4ccccc4OC)cs3)CC2)c1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.61
L3MBTL1 Q9Y468 2/20 0.61
USP2 O75604 2/20 0.61
LMNA P02545 1/20 0.61
HTT P42858 1/20 0.61
KMT2A Q03164 5/20 0.58
MAPT P10636 2/20 0.55
RECQL P46063 2/20 0.55
KDM4E B2RXH2 1/20 0.55
HPGD P15428 1/20 0.51
GAA P10253 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPK1 P28482 1/20 0.46
MEN1 O00255 1/20 0.46
TP53 P04637 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL3012014 0.94 ALDH1A1 (0.56) ALDH1A1L3MBTL1USP2LMNAHTT
SCHEMBL3006233 0.93 ALDH1A1 (0.61) ALDH1A1L3MBTL1USP2LMNAHTT
SCHEMBL3003817 0.93 ALDH1A1 (0.51) ALDH1A1L3MBTL1USP2LMNAHTT
SCHEMBL3014595 0.93 ALDH1A1 (0.55) ALDH1A1L3MBTL1USP2LMNAHTT
SCHEMBL3008166 0.91 LMNA (0.54) ALDH1A1L3MBTL1USP2LMNAHTT
SCHEMBL3015128 0.90 GAA (0.51) ALDH1A1L3MBTL1USP2LMNAHTT
SCHEMBL3012857 0.90 KMT2A (0.57) ALDH1A1L3MBTL1USP2LMNAHTT
SCHEMBL3010426 0.90 ALDH1A1 (0.61) ALDH1A1L3MBTL1USP2LMNAHTT
SCHEMBL3019561 0.88 ALDH1A1 (0.51) ALDH1A1L3MBTL1USP2LMNAHTT
SCHEMBL3005294 0.88 TP53 (0.56) ALDH1A1L3MBTL1USP2LMNAKMT2A

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 3510/4885L3MBTL1 1847/4885USP2 1831/4885

“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.