SCHEMBL3043860

SCHEMBL3043860

Cc1csc(Cl)c1NC(=S)Oc1ccccn1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.35
NPC1 O15118 7/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
THRB P10828 1/20 0.35
NPSR1 Q6W5P4 4/20 0.34
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
NFKB1 P19838 2/20 0.34
NFKB2 Q00653 2/20 0.34
RELA Q04206 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 1/20 0.34
GRM4 Q14833 1/20 0.33
PKM P14618 2/20 0.33
KDM4E B2RXH2 2/20 0.33

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
SCHEMBL3035284 0.75 MAPT (0.49) RAB9ANPC1SMN1; SMN2THRBNPSR1
SCHEMBL4298747 0.73 RAB9A (0.53) RAB9ANPC1SMN1; SMN2NPSR1ALDH1A1
SCHEMBL13971212 0.68
SCHEMBL3043862 0.68 TLR7 (0.34) RAB9ANPC1SMN1; SMN2NPSR1ALDH1A1
SCHEMBL3040193 0.68 KMT2A (0.38) SMN1; SMN2ALDH1A1MAPTCYP1A2CYP2C19
SCHEMBL19435589 0.65 KDM4E (0.41) RAB9ANPC1SMN1; SMN2NPSR1ALDH1A1
SCHEMBL5577241 0.65 KDM4E (0.41) RAB9ANPC1SMN1; SMN2NPSR1ALDH1A1
SCHEMBL435144 0.64 KDM4E (0.44) RAB9ANPC1SMN1; SMN2NPSR1ALDH1A1
SCHEMBL31734268 0.64 KDM4E (0.44) RAB9ANPC1SMN1; SMN2NPSR1ALDH1A1
SCHEMBL21875055 0.63 KMT2A (0.45) RAB9AALDH1A1LMNAL3MBTL1MAPT

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 10 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
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
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
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
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 RAB9A 1355/4885NPC1 133/4885SMN1; SMN2 1886/4885

“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.