SCHEMBL3015113

SCHEMBL3015113

CCCc1ccc(Cc2csc(N3CCC(S(=O)(=O)c4ccccc4C(F)(F)F)CC3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSS P25774 14/20 0.44
HSD11B1 P28845 1/20 0.39
SCD O00767 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL3002549 0.93 CTSS (0.45) CTSSHSD11B1SCDL3MBTL1
SCHEMBL3012385 0.91 CTSS (0.45) CTSSSCDL3MBTL1
SCHEMBL3001422 0.91 CTSS (0.47) CTSSSCDL3MBTL1
SCHEMBL3018638 0.89 CTSS (0.44) CTSSSCDL3MBTL1
SCHEMBL3003065 0.89 CTSS (0.44) CTSSSCDL3MBTL1
SCHEMBL3008339 0.89 CTSS (0.45) CTSSSCD
SCHEMBL3021202 0.88 MEN1 (0.47) CTSSL3MBTL1
SCHEMBL3019209 0.87 CTSS (0.46) CTSSSCDL3MBTL1
SCHEMBL2999646 0.87 CTSS (0.45) CTSSSCDL3MBTL1
SCHEMBL3017783 0.86 CTSS (0.42) CTSS

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 106/4885HSD11B1 1034/4885SCD 2651/4885

“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.