SCHEMBL2998872

SCHEMBL2998872

CCOc1ccc(-c2csc(N3CCC(S(=O)(=O)c4c(F)c(F)c(F)c(F)c4F)CC3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.48
MAPT P10636 6/20 0.48
MAPK1 P28482 5/20 0.48
RAB9A P51151 5/20 0.48
LMNA P02545 5/20 0.48
HTT P42858 2/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 4/20 0.45
NPC1 O15118 4/20 0.45
ALDH1A1 P00352 3/20 0.44
TSHR P16473 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
AR P10275 1/20 0.42
NR2F2 P24468 1/20 0.41
MCOLN3 Q8TDD5 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
SCHEMBL3010922 0.91 MAPT (0.47) SMN1; SMN2MAPTMAPK1RAB9ALMNA
SCHEMBL3006478 0.89 SMN1; SMN2 (0.60) SMN1; SMN2MAPTMAPK1RAB9ALMNA
SCHEMBL2998418 0.88 SMN1; SMN2 (0.55) SMN1; SMN2MAPTMAPK1RAB9ALMNA
SCHEMBL3009046 0.87 MAPK1 (0.49) SMN1; SMN2MAPTMAPK1RAB9ALMNA
SCHEMBL3016555 0.87 SMN1; SMN2 (0.42) SMN1; SMN2MAPTMAPK1RAB9ALMNA
SCHEMBL3013590 0.87 SMN1; SMN2 (0.46) SMN1; SMN2MAPTMAPK1RAB9ALMNA
SCHEMBL3021994 0.87 SMN1; SMN2 (0.46) SMN1; SMN2MAPTMAPK1RAB9ALMNA
SCHEMBL3008237 0.86 SMN1; SMN2 (0.58) SMN1; SMN2MAPTMAPK1RAB9ALMNA
SCHEMBL3020108 0.85 L3MBTL1 (0.48) SMN1; SMN2MAPTMAPK1RAB9ALMNA
SCHEMBL3011220 0.85 MAPT (0.35) SMN1; SMN2MAPTMAPK1RAB9ALMNA

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 SMN1; SMN2 1/4885MAPT 18/4885MAPK1 2767/4885

“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.