SCHEMBL3016706

SCHEMBL3016706

CCCc1ccc(Cc2csc(N3CCC(S(=O)(=O)c4ccc(Cl)cc4)CC3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.37
HTR2A P28223 3/20 0.37
HTR2C P28335 3/20 0.37
KCNH2 Q12809 2/20 0.37
DRD2 P14416 1/20 0.37
LMNA P02545 3/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL3017031 0.93 MAPT (0.42) MAPTHTR2AHTR2CKCNH2DRD2
SCHEMBL3012962 0.92 AOC3 (0.34) MAPTHTR2AHTR2CKCNH2LMNA
SCHEMBL3018372 0.92 MAPT (0.39) MAPTHTR2AHTR2CKCNH2DRD2
SCHEMBL3003387 0.91 GBA1 (0.41) MAPTHTR2AHTR2CKCNH2SMN1; SMN2
SCHEMBL3006927 0.90 RAB9A (0.37) HTR2AHTR2CKCNH2SMN1; SMN2MEN1
SCHEMBL3002808 0.90 HTR2A (0.35) HTR2AHTR2CKCNH2
SCHEMBL3017562 0.90 SMN1; SMN2 (0.39) MAPTHTR2AHTR2CKCNH2DRD2
SCHEMBL3001231 0.90 MAPT (0.42) MAPTHTR2AHTR2CKCNH2DRD2
SCHEMBL3011260 0.90 MAPT (0.42) MAPTHTR2AHTR2CKCNH2DRD2
SCHEMBL3022148 0.90 LMNA (0.36) HTR2AHTR2CLMNA

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 MAPT 18/4885HTR2A 752/4885HTR2C 1153/4885

“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.