SCHEMBL3014091

SCHEMBL3014091

CCCc1ccc(Cc2csc(N3CCC(S(=O)(=O)c4c(F)c(F)c(F)c(F)c4F)CC3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
MAPK1 P28482 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ADAMTS5 Q9UNA0 1/20 0.32
AR P10275 1/20 0.32
APLNR P35414 1/20 0.31

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
SCHEMBL3013007 0.92 HRH3 (0.35) AOC3HRH3MAPK1L3MBTL1MEN1
SCHEMBL3003782 0.90 AR (0.40) AOC3HRH3MAPK1MEN1LMNA
SCHEMBL3009601 0.90 SMN1; SMN2 (0.39) HRH3MAPK1KMT2ANPC1RAB9A
SCHEMBL3015850 0.88 MAPT (0.39) HRH3MAPK1L3MBTL1LMNANPC1
SCHEMBL3021337 0.88 NPC1 (0.39) HRH3MAPK1L3MBTL1MEN1LMNA
SCHEMBL3011220 0.88 MAPT (0.35) HRH3MAPK1MEN1LMNAKMT2A
SCHEMBL3008978 0.87 RAB9A (0.41) HRH3MAPK1MEN1LMNAKMT2A
SCHEMBL3017562 0.87 SMN1; SMN2 (0.39) HRH3MAPK1L3MBTL1LMNANPC1
SCHEMBL3018237 0.87 AOC3 (0.33) AOC3HRH3NPC1RAB9ASMN1; SMN2
SCHEMBL3016708 0.87 DNM1L (0.35) AOC3HRH3

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 AOC3 2304/4885HRH3 2846/4885MAPK1 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.