SCHEMBL4757488

SCHEMBL4757488

CC(=O)Oc1c(Br)cccc1C(=O)Nc1nc(NS(C)(=O)=O)cs1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.41
NPC1 O15118 6/20 0.40
RAB9A P51151 5/20 0.40
MAPK1 P28482 2/20 0.39
PDE5A O76074 2/20 0.39
PDE1A P54750 2/20 0.39
PDE1B Q01064 2/20 0.39
PDE1C Q14123 2/20 0.39
ALDH1A1 P00352 4/20 0.38
HPGD P15428 3/20 0.38
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 2/20 0.38
HTT P42858 2/20 0.38
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
RCE1 Q9Y256 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GCK P35557 2/20 0.37
TSHR P16473 1/20 0.37
MEN1 O00255 3/20 0.36

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
SCHEMBL4757512 0.88 NPC1 (0.40) NPC1RAB9AMAPK1ALDH1A1HPGD
SCHEMBL4757484 0.86 SORT1 (0.40) SLC2A1NPC1RAB9AMAPK1PDE5A
SCHEMBL4757394 0.77 NPC1 (0.64) NPC1RAB9AMAPK1ALDH1A1HPGD
SCHEMBL4937272 0.76 SLC2A1 (0.39) SLC2A1NPC1RAB9AMAPK1PDE5A
SCHEMBL4756354 0.74 RAB9A (0.50) NPC1RAB9AMAPK1PDE5APDE1A
SCHEMBL4757398 0.73 SORT1 (0.51) NPC1RAB9AALDH1A1HPGDHSD17B10
SCHEMBL4756806 0.73 PDE5A (0.46) SLC2A1NPC1RAB9AMAPK1PDE5A
SCHEMBL4756640 0.71 GRM4 (0.50) NPC1RAB9AALDH1A1HPGDHSD17B10
SCHEMBL10114456 0.71 PDE5A (0.44) NPC1RAB9AMAPK1PDE5APDE1A
SCHEMBL27792623 0.70 NPC1 (0.60) NPC1RAB9AMAPK1ALDH1A1HPGD

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-8895752-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES L.C. (US) 2014-11-25 US disclosed
US-8895752-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES L.C. (US) 2014-11-25 US disclosed
US-20120122939-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES, L.C. 2012-05-17 US disclosed
US-8124632-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES, L.C. (US) 2012-02-28 US disclosed
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES L.C. 2009-02-05 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 (2 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-20120122939-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC SLC2A1 2505/4885NPC1 585/4885RAB9A 1694/4885
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC SLC2A1 2505/4885NPC1 585/4885RAB9A 1694/4885

“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.