SCHEMBL3014949

SCHEMBL3014949

O=S(=O)(c1ccc(F)cc1Cl)C1CCN(c2nc(Cc3ccc(Cl)c(Cl)c3)cs2)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSS P25774 7/20 0.45
L3MBTL1 Q9Y468 3/20 0.36
LMNA P02545 1/20 0.36
AR P10275 3/20 0.35
NAAA Q02083 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
GRM5 P41594 1/20 0.34
CCNC P24863 1/20 0.34
CDK8 P49336 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL3008760 0.94 CTSS (0.45) CTSSL3MBTL1LMNANAAASMN1; SMN2
SCHEMBL3008998 0.94 CTSS (0.45) CTSSL3MBTL1LMNAARNAAA
SCHEMBL3003667 0.94 CTSS (0.39) CTSSL3MBTL1LMNAARNAAA
SCHEMBL3016792 0.92 CTSS (0.45) CTSSL3MBTL1LMNANAAASMN1; SMN2
SCHEMBL3003446 0.92 CTSS (0.46) CTSSL3MBTL1NAAASMN1; SMN2ALDH1A1
SCHEMBL3008156 0.91 GAA (0.39) CTSSL3MBTL1LMNAARSMN1; SMN2
SCHEMBL3007308 0.91 CTSS (0.47) CTSSL3MBTL1LMNANAAASMN1; SMN2
SCHEMBL3013842 0.91 CTSS (0.47) CTSSL3MBTL1NAAASMN1; SMN2ALDH1A1
SCHEMBL3016743 0.90 CTSS (0.36) CTSSL3MBTL1LMNAARNAAA
SCHEMBL3016624 0.90 CTSS (0.43) CTSSL3MBTL1NAAASMN1; SMN2ALDH1A1

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 106/4885L3MBTL1 1847/4885LMNA 80/4885

“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.