SCHEMBL3018943

SCHEMBL3018943

COc1cc(Cc2csc(N3CCN(S(=O)(=O)c4ccc(Cl)cc4Cl)CC3)n2)cc(OC)c1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2C9 P11712 1/20 0.44
LMNA P02545 4/20 0.42
MAPT P10636 4/20 0.42
TSHR P16473 1/20 0.42
TRPV4 Q9HBA0 1/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
TP53 P04637 2/20 0.41
USP2 O75604 1/20 0.39
THRB P10828 1/20 0.39
LPAR1 Q92633 1/20 0.39
LPAR2 Q9HBW0 1/20 0.39
HSD11B1 P28845 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL3021361 0.93 CYP3A4 (0.53) CYP3A4CYP2C19CYP2C9LMNAMAPT
SCHEMBL3011886 0.93 CYP3A4 (0.48) CYP3A4CYP2C19CYP2C9LMNAMAPT
SCHEMBL3018547 0.91 GAA (0.40) CYP3A4CYP2C19CYP2C9LMNAMAPT
SCHEMBL3000530 0.91 MAPT (0.43) LMNAMAPTTSHRALDH1A1KDM4E
SCHEMBL3018886 0.91 MAPT (0.44) CYP3A4CYP2C19LMNAMAPTTSHR
SCHEMBL3014976 0.90 MEN1 (0.43) CYP3A4CYP2C19CYP2C9LMNAMAPT
SCHEMBL3017960 0.89 MAPT (0.45) LMNAMAPTALDH1A1KDM4EPOLB
SCHEMBL3002069 0.89 TRPV4 (0.43) CYP3A4CYP2C19LMNAMAPTTSHR
SCHEMBL3016779 0.88 TP53 (0.45) CYP3A4CYP2C19CYP2C9MAPTTSHR
SCHEMBL3014572 0.87 ACLY (0.46) LMNAMAPTTSHRTRPV4ALDH1A1

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 CYP3A4 4794/4885CYP2C19 4845/4885CYP2C9 4880/4885

“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.