SCHEMBL3016556

SCHEMBL3016556

N#Cc1ccccc1S(=O)(=O)C1CCN(c2nc(Cc3cc(F)cc(F)c3)cs2)CC1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.48
HTR2C P28335 2/20 0.48
DRD2 P14416 1/20 0.48
KCNH2 Q12809 1/20 0.48
CTSS P25774 14/20 0.37
NAAA Q02083 3/20 0.36

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
SCHEMBL3015360 0.94 HTR2A (0.45) HTR2AHTR2CDRD2KCNH2CTSS
SCHEMBL3005425 0.90 DRD2 (0.42) HTR2AHTR2CDRD2KCNH2CTSS
SCHEMBL3016445 0.90 DRD2 (0.43) HTR2AHTR2CDRD2KCNH2CTSS
SCHEMBL3011443 0.90 HTR2A (0.47) HTR2AHTR2CDRD2KCNH2CTSS
SCHEMBL3017397 0.89 DRD2 (0.42) HTR2AHTR2CDRD2KCNH2CTSS
SCHEMBL3010009 0.87 HTR2A (0.45) HTR2AHTR2CDRD2KCNH2CTSS
SCHEMBL3012908 0.87 HTR2A (0.45) HTR2AHTR2CDRD2KCNH2CTSS
SCHEMBL3015476 0.87 DRD2 (0.40) HTR2AHTR2CDRD2KCNH2CTSS
SCHEMBL3016066 0.87 DRD2 (0.41) HTR2AHTR2CDRD2KCNH2CTSS
SCHEMBL3008762 0.86 DRD2 (0.41) HTR2AHTR2CDRD2KCNH2CTSS

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 1153/4885DRD2 573/4885

“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.