SCHEMBL2924425

SCHEMBL2924425

C=C(N)CSn1cnc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ HTT P42858 4/20 0.38
▸ CYP11B1 P15538 2/20 0.38
▸ CYP11B2 P19099 2/20 0.38
▸ TNF P01375 1/20 0.38
▸ EGLN3 Q9H6Z9 1/20 0.38
▸ ASAH1 Q13510 1/20 0.38
▸ FGFR1 P11362 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ STAT6 P42226 1/20 0.36
▸ GGPS1 O95749 1/20 0.36
▸ FDPS P14324 1/20 0.36
▸ DNMT3A Q9Y6K1 1/20 0.36
▸ MAPK1 P28482 1/20 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
SCHEMBL9460847 0.79 POLB (0.40) TDP1KDM4ENPC1HTTCYP11B1
SCHEMBL8413080 0.78 TDP1 (0.48) TDP1HTTCYP11B1CYP11B2TNF
SCHEMBL6530090 0.76 TDP1 (0.46) TDP1KDM4ENPC1HTTCYP11B1
SCHEMBL9060998 0.75 TDP1 (0.48) TDP1HTTCYP11B1CYP11B2TNF
SCHEMBL1939000 0.74 TDP1 (0.44) TDP1HTTCYP11B1CYP11B2TNF
SCHEMBL10735469 0.73 TDP1 (0.43) TDP1KDM4ENPC1HTTCYP11B1
SCHEMBL11269104 0.73 KDM4E (0.44) KDM4ENPC1HTTEGLN3ASAH1
SCHEMBL8792548 0.72 TDP1 (0.46) TDP1HTTCYP11B1CYP11B2TNF
SCHEMBL11451311 0.72 TDP1 (0.46) TDP1KDM4EHTTCYP11B1CYP11B2
SCHEMBL6529410 0.72 CYP11B1 (0.53) TDP1NPC1HTTCYP11B1CYP11B2

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
US-7795445-B2 Substituted 2-aminoalkylthiobenzimidazole compounds, pharmaceutical compositions thereof and methods for their use SANOFI-AVENTIS (FR) 2010-09-14 — — US disclosed
US-7795445-B2 Substituted 2-aminoalkylthiobenzimidazole compounds, pharmaceutical compositions thereof and methods for their use SANOFI-AVENTIS (FR) 2010-09-14 — — US disclosed
US-7795445-B2 Substituted 2-aminoalkylthiobenzimidazole compounds, pharmaceutical compositions thereof and methods for their use SANOFI-AVENTIS (FR) 2010-09-14 — — US disclosed
EP-1874737-B1 SUBSTITUTED 2-AMINOALKYLTHIO-BENZIMIDAZOLES AND USE THEREOF FOR REDUCING BLOOD SUGAR LEVELS SANOFI AVENTIS (FR) 2010-08-04 — — EP disclosed
US-20080090889-A1 SUBSTITUTED 2-AMINOALKYLTHIOBENZIMIDAZOLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF AND METHODS FOR THEIR USE SANOFI-AVENTIS (FR) 2008-04-17 — — US disclosed
US-20080090889-A1 SUBSTITUTED 2-AMINOALKYLTHIOBENZIMIDAZOLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF AND METHODS FOR THEIR USE SANOFI-AVENTIS (FR) 2008-04-17 — — US disclosed
EP-1874737-A1 SUBSTITUTED 2-AMIN0ALKYLTHI0-BENZIMIDAZ0LES AND USE THEREOF FOR REDUCING BLOOD SUGAR LEVELS sanofi-aventis (FR) 2008-01-09 — — EP disclosed
EP-1874737-A1 SUBSTITUTED 2-AMIN0ALKYLTHI0-BENZIMIDAZ0LES AND USE THEREOF FOR REDUCING BLOOD SUGAR LEVELS sanofi-aventis (FR) 2008-01-09 — — EP disclosed
WO-2006111261-A1 SUBSTITUTED 2-AMIN0ALKYLTHI0-BENZIMIDAZ0LES AND USE THEREOF FOR REDUCING BLOOD SUGAR LEVELS SANOFI-AVENTIS (DE) 2006-10-26 — — WO disclosed
WO-2006111261-A1 SUBSTITUTED 2-AMIN0ALKYLTHI0-BENZIMIDAZ0LES AND USE THEREOF FOR REDUCING BLOOD SUGAR LEVELS SANOFI-AVENTIS (DE) 2006-10-26 — — 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-20080090889-A1 SUBSTITUTED 2-AMINOALKYLTHIOBENZIMIDAZOLE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF AND METHODS FOR THEIR USE SLC5A2, GPR119, SLC2A2 TDP1 1920/4885KDM4E 1610/4885NPC1 406/4885

“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.

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