SCHEMBL3017754

SCHEMBL3017754

O=S(=O)(c1ccc(F)cc1F)C1CCN(c2nc(Cc3ccc(Cl)cc3Cl)cs2)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.43
HTR2C P28335 6/20 0.43
KCNH2 Q12809 5/20 0.43
DRD2 P14416 3/20 0.43
EPHX2 P34913 4/20 0.42
CTSS P25774 4/20 0.39
CA2 P00918 1/20 0.37
GPR6 P46095 1/20 0.37
GAA P10253 1/20 0.35
LMNA P02545 1/20 0.35
NAAA Q02083 1/20 0.35
AR P10275 1/20 0.34

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
SCHEMBL3014906 0.94 CTSS (0.45) HTR2AHTR2CKCNH2DRD2EPHX2
SCHEMBL3006778 0.90 GAA (0.39) EPHX2CTSSGAAAR
SCHEMBL3013143 0.90 EPHX2 (0.41) HTR2AHTR2CKCNH2DRD2EPHX2
SCHEMBL3010789 0.89 HTR2A (0.42) HTR2AHTR2CKCNH2DRD2CTSS
SCHEMBL3008061 0.88 EPHX2 (0.55) HTR2AHTR2CKCNH2DRD2EPHX2
SCHEMBL3017428 0.88 CTSS (0.39) HTR2AHTR2CKCNH2DRD2CTSS
SCHEMBL3004614 0.88 CTSS (0.39) HTR2AHTR2CKCNH2DRD2CTSS
SCHEMBL3000548 0.87 GAA (0.38) EPHX2GAAAR
SCHEMBL3014501 0.86 ALDH1A1 (0.43) HTR2AHTR2CEPHX2GAALMNA
SCHEMBL3003667 0.86 CTSS (0.39) HTR2AHTR2CKCNH2DRD2CTSS

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 HTR2A 752/4885HTR2C 1153/4885KCNH2 3130/4885

“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.