SCHEMBL3007871

SCHEMBL3007871

O=S(=O)(c1ccc(Cl)cc1Cl)C1CCN(c2nc(Cc3cccc(Br)c3)cs2)CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSS P25774 9/20 0.37
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.35
TRPV4 Q9HBA0 1/20 0.35
AR P10275 1/20 0.34
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
NR3C1 P04150 1/20 0.32

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
SCHEMBL3013907 0.95 CTSS (0.38) CTSSRAB9ASMN1; SMN2KMT2ANR3C1
SCHEMBL3011745 0.93 RAB9A (0.36) CTSSRAB9ASMN1; SMN2GAAMAPT
SCHEMBL3012276 0.91 CTSS (0.47) CTSSRAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL3012034 0.91 CTSS (0.43) CTSSRAB9ASMN1; SMN2KMT2ANR3C1
SCHEMBL3014674 0.91 TRPV4 (0.42) CTSSRAB9ASMN1; SMN2GAATRPV4
SCHEMBL3002782 0.90 CTSS (0.37) CTSSRAB9ASMN1; SMN2GAATRPV4
SCHEMBL3019472 0.89 CTSS (0.36) CTSSRAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL3013818 0.89 MAPT (0.36) CTSSRAB9ASMN1; SMN2GAAMAPT
SCHEMBL3015043 0.89 GAA (0.40) CTSSRAB9ASMN1; SMN2GAATRPV4
SCHEMBL3006012 0.89 MAPT (0.39) CTSSRAB9ASMN1; SMN2GAATRPV4

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 106/4885RAB9A 2943/4885SMN1; SMN2 1/4885

“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.