SCHEMBL3004444

SCHEMBL3004444

Cc1cccc(C)c1-c1csc(N2CCC(S(=O)(=O)c3ccccc3Cl)CC2)n1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSS P25774 3/20 0.48
SMN1; SMN2 Q16637 9/20 0.45
RAB9A P51151 5/20 0.45
NPC1 O15118 4/20 0.43
MEN1 O00255 2/20 0.41
LMNA P02545 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL2997924 0.93 CTSS (0.45) CTSSSMN1; SMN2RAB9ANPC1
SCHEMBL3005439 0.92 CTSS (0.45) CTSSSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3011986 0.90 SMN1; SMN2 (0.47) CTSSSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3003914 0.89 SMN1; SMN2 (0.47) CTSSSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3012831 0.89 SMN1; SMN2 (0.47) CTSSSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3010401 0.89 CTSS (0.46) CTSSSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL2998190 0.88 SMN1; SMN2 (0.43) CTSSSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3002322 0.88 CTSS (0.43) CTSSSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3006066 0.88 CTSS (0.52) CTSSSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL3016446 0.88 SMN1; SMN2 (0.42) CTSSSMN1; SMN2RAB9ANPC1MEN1

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

“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.