SCHEMBL4282388

SCHEMBL4282388

CCCCCN(C(=N)N)c1ccc(S(F)(F)(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
PAX8 Q06710 2/20 0.38
JAK2 O60674 1/20 0.38
GRIN2D O15399 3/20 0.35
GRIN3B O60391 3/20 0.35
GRIN1 Q05586 3/20 0.35
GRIN2A Q12879 3/20 0.35
GRIN2B Q13224 3/20 0.35
GRIN2C Q14957 3/20 0.35
GRIN3A Q8TCU5 3/20 0.35
MLYCD O95822 5/20 0.33
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
GPX4 P36969 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PDE2A O00408 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
SCHEMBL10598512 0.80 NPC1 (0.56) NPC1RAB9APAX8JAK2GRIN2D
SCHEMBL5144850 0.79 NPC1 (0.46) NPC1RAB9APAX8JAK2ALDH1A1
SCHEMBL8028077 0.76 NPC1 (0.42) NPC1RAB9APAX8JAK2GRIN2D
SCHEMBL4983976 0.74 MEN1 (0.50) NPC1RAB9APAX8JAK2GRIN2D
Hydrochloric Acid SCHEMBL8194065 0.73 GRIN2D (0.49) NPC1RAB9APAX8JAK2GRIN2D
Hydrochloric Acid SCHEMBL7571060 0.71 ALOX5 (0.45) NPC1RAB9APAX8JAK2GRIN2D
SCHEMBL10597779 0.70 TRPV1 (0.44) NPC1RAB9APAX8JAK2GRIN2D
SCHEMBL3744394 0.69 SIGMAR1 (0.43) ALDH1A1
SCHEMBL10824119 0.67 MEN1 (0.53) NPC1RAB9APAX8JAK2GRIN2D
SCHEMBL8802180 0.66 ESR1 (0.49) ALDH1A1TP53

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036704-A1 Process for Preparing 4-Pentafluorosulfanylbenzoylguanidines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-02-05 US claimed
US-7449594-B2 Process for preparing 4-pentafluorosulfanylbenzoylguanidines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-11-11 US claimed
US-20070106094-A1 Process For Preparing 4-Pentafluorosulfanylbenzoylguanidines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-05-10 US claimed
US-7126026-B2 Process for preparing 4-pentafluorosulfanylbenzoylguanidines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-10-24 US claimed
US-20050131070-A1 Process for preparing 4-pentafluorosulfanylbenzoylguanidines AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-06-16 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20090036704-A1 Process for Preparing 4-Pentafluorosulfanylbenzoylguanidines NHERF1, SLC9A1, SLC5A1 NPC1 469/4885RAB9A 376/4885PAX8 3452/4885
US-20050131070-A1 Process for preparing 4-pentafluorosulfanylbenzoylguanidines NHERF1, SLC9A1, SLC5A1 NPC1 469/4885RAB9A 376/4885PAX8 3452/4885
US-20070106094-A1 Process For Preparing 4-Pentafluorosulfanylbenzoylguanidines PAH, NCEH1, PNMT NPC1 333/4885RAB9A 887/4885PAX8 4034/4885

“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.