SCHEMBL3014810

SCHEMBL3014810

CCCc1ccc(Cc2csc(N3CCC(S(=O)(=O)c4ccc(Br)cc4Cl)CC3)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSS P25774 11/20 0.34
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
AOC3 Q16853 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
SCHEMBL3008468 0.93 CTSS (0.35) CTSSMEN1NPC1RAB9AKMT2A
SCHEMBL3017401 0.91 SMN1; SMN2 (0.35) CTSSMEN1NPC1RAB9AKMT2A
SCHEMBL3015052 0.91 GAA (0.35) CTSSNPC1RAB9ASMN1; SMN2AOC3
SCHEMBL3013818 0.91 MAPT (0.36) CTSSMEN1NPC1RAB9AKMT2A
SCHEMBL3015766 0.90 CTSS (0.45) CTSS
SCHEMBL3019472 0.89 CTSS (0.36) CTSSMEN1NPC1RAB9AKMT2A
SCHEMBL3014694 0.89 CNR2 (0.41) CTSSNPC1RAB9ASMN1; SMN2
SCHEMBL2999691 0.89 RAB9A (0.37) CTSSNPC1RAB9ASMN1; SMN2
SCHEMBL3012960 0.89 LMNA (0.36) CTSSMEN1NPC1RAB9AKMT2A
SCHEMBL3002528 0.88 CTSS (0.35) CTSSMEN1NPC1RAB9AKMT2A

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 106/4885MEN1 454/4885NPC1 15/4885

“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.