SCHEMBL3020009

SCHEMBL3020009

CCOc1ccc(Cc2csc(N3CCC(S(=O)(=O)c4ccc(F)cc4Cl)CC3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSS P25774 13/20 0.45
CNR2 P34972 2/20 0.41
HSD11B1 P28845 1/20 0.39
TP53 P04637 2/20 0.38
SCN9A Q15858 1/20 0.35
MAPT P10636 2/20 0.34
LMNA P02545 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
SCHEMBL3009850 0.92 CNR2 (0.41) CTSSCNR2TP53SCN9AMAPT
SCHEMBL3011350 0.92 GPR6 (0.39) CTSSCNR2TP53SCN9AMAPT
SCHEMBL2998519 0.92 CTSS (0.45) CTSSTP53MAPTLMNA
SCHEMBL3011818 0.91 CTSS (0.46) CTSS
SCHEMBL3014694 0.90 CNR2 (0.41) CTSSCNR2TP53MAPTLMNA
SCHEMBL3009935 0.89 MAPT (0.35) CTSSCNR2TP53MAPTLMNA
SCHEMBL3015766 0.89 CTSS (0.45) CTSS
SCHEMBL3018853 0.89 CTSS (0.45) CTSS
SCHEMBL3003446 0.89 CTSS (0.46) CTSSTP53SCN9AMAPT
SCHEMBL3006934 0.88 CTSS (0.42) CTSSCNR2MAPTLMNA

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 CTSS 106/4885CNR2 2911/4885HSD11B1 1034/4885

“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.