SCHEMBL3043862

SCHEMBL3043862

Cc1csc(Cl)c1N(S)C(=O)Oc1ccccn1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.34
GRM4 Q14833 1/20 0.34
NPC1 O15118 6/20 0.33
RAB9A P51151 6/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TP53 P04637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PKM P14618 2/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.32
NAPRT Q6XQN6 1/20 0.32
P4HTM Q9NXG6 1/20 0.32
MAPT P10636 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GRM1 Q13255 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
SCHEMBL3043860 0.68 RAB9A (0.35) TLR7GRM4NPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL29361741 0.67 RAB9A (0.47) NPC1RAB9AKMT2APKMTSHR
SCHEMBL2218296 0.66 ALDH1A1 (0.39) NPC1RAB9ASMN1; SMN2L3MBTL1PKM
SCHEMBL10697750 0.65 MEN1 (0.53) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL1694615 0.64 LMNA (0.42) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL5502069 0.64 L3MBTL1 (0.58) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL7351837 0.63 CES2 (0.43) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL2523378 0.63 CES2 (0.43) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL29944969 0.63 CES2 (0.43) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1
SCHEMBL29721865 0.63 KDM4E (0.50) NPC1RAB9ASMN1; SMN2KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2170872-A2 PROCESS FOR THE PREPARATION OF BENZIMIDAZOL THIENYLAMINE COMPOUNDS AND INTERMEDIATES THEREOF Sanofi-Aventis U.S. LLC (US) 2010-04-07 EP claimed
WO-2009006066-A2 PROCESS FOR THE PREPARATION OF BENZIMIDAZOL THIENYLAMINE COMPOUNDS AND INTERMEDIATES THEREOF SANOFI-AVENTIS U.S. LLC (US) 2009-01-08 WO claimed
EP-2170872-B1 PROCESS FOR THE PREPARATION OF THE N-(2-CHLORO-4-METHYL-3-THIENYL)-1H- BENZIMIDAZOL-2-AMINE HYDROCHLORIDE AND INTERMEDIATES THEREOF SANOFI AVENTIS US LLC (US) 2010-09-01 EP disclosed
US-20100174088-A1 PROCESS FOR THE PREPARATION OF BENZIMIDAZOL THIENYLAMINE COMPOUNDS AND DERIVATIVES THEREOF USEFUL AS SODIUM/PROTON EXCHANGER TYPE 3 INHIBITORS SANOFI-AVENTIS U.S. LLC (US) 2010-07-08 US disclosed
EP-2170872-A2 PROCESS FOR THE PREPARATION OF BENZIMIDAZOL THIENYLAMINE COMPOUNDS AND INTERMEDIATES THEREOF Sanofi-Aventis U.S. LLC (US) 2010-04-07 EP disclosed
WO-2009006066-A2 PROCESS FOR THE PREPARATION OF BENZIMIDAZOL THIENYLAMINE COMPOUNDS AND INTERMEDIATES THEREOF SANOFI-AVENTIS U.S. LLC (US) 2009-01-08 WO 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-20100174088-A1 PROCESS FOR THE PREPARATION OF BENZIMIDAZOL THIENYLAMINE COMPOUNDS AND DERIVATIVES THEREOF USEFUL AS SODIUM/PROTON EXCHANGER TYPE 3 INHIBITORS SLC9A3, NHERF1, SLC9A5 TLR7 4521/4885GRM4 2446/4885NPC1 133/4885

“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.