SCHEMBL25344145

SCHEMBL25344145

C[Si](C)(C)CCOCn1nc(I)c2ccc(OCC(F)(F)F)cc21

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 7/20 0.45
SCN9A Q15858 3/20 0.32
PTPN1 P18031 1/20 0.32
CYP17A1 P05093 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
NPC1 O15118 1/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAOB P27338 1/20 0.30
SCN5A Q14524 1/20 0.30
DUT P33316 1/20 0.30

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
SCHEMBL25347331 0.84 DGAT1 (0.43) DGAT1SCN9APTPN1CYP17A1CYP2C9
SCHEMBL1965693 0.83 DGAT1 (0.42) DGAT1PTPN1CYP2C9NPC1ALDH1A1
SCHEMBL5247838 0.80 NPC1 (0.36) DGAT1NPC1
SCHEMBL15304363 0.79 NPC1 (0.35) DGAT1NPC1
SCHEMBL1329995 0.78 DGAT1 (0.43) DGAT1NPC1
SCHEMBL1964251 0.77 DGAT1 (0.42) DGAT1PTPN1CYP2C9NPC1ALDH1A1
SCHEMBL586069 0.75 NPC1 (0.35) DGAT1NPC1
SCHEMBL2194569 0.75 NPC1 (0.45) DGAT1NPC1ALDH1A1
SCHEMBL31609652 0.75 NPC1 (0.45) DGAT1NPC1ALDH1A1
SCHEMBL7217186 0.74 FYN (0.32) DGAT1CYP2C19NPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 US disclosed
US-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 US disclosed
US-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 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 (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-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 DGAT1 1007/4885SCN9A 1633/4885PTPN1 1411/4885

“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.