SCHEMBL29653724

SCHEMBL29653724

FC(F)(F)CN1CCC(c2ccc3[nH]c(Nc4cc(Cl)c5cc[nH]c5c4)nc3c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TLR9 Q9NR96 11/20 0.42
▸ TLR8 Q9NR97 11/20 0.42
▸ TLR7 Q9NYK1 11/20 0.42
▸ JAK1 P23458 3/20 0.38
▸ JAK2 O60674 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ JAK3 P52333 1/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ BTK Q06187 2/20 0.37
▸ CNR1 P21554 1/20 0.34
▸ SYK P43405 1/20 0.34
▸ MAP3K11 Q16584 1/20 0.34

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
SCHEMBL24549101 1.00 TLR9 (0.42) TLR9TLR8TLR7JAK1JAK2
SCHEMBL24549464 0.87 SYK (0.37) JAK1JAK2TYK2KCNH2BTK
SCHEMBL29653718 0.87 SYK (0.37) JAK1JAK2TYK2KCNH2BTK
SCHEMBL24549232 0.86 KCNH2 (0.44) TLR9TLR8TLR7KCNH2BTK
SCHEMBL24549228 0.85 SYK (0.38) KCNH2BTKSYK
SCHEMBL29132145 0.84 BTK (0.37) TLR9TLR8TLR7KCNH2BTK
SCHEMBL24549239 0.84 BTK (0.42) BTKSYK
SCHEMBL24549233 0.83 SYK (0.35) KCNH2BTKSYK
SCHEMBL24548986 0.82 SYK (0.37) JAK1JAK2TYK2JAK3KCNH2
SCHEMBL24549099 0.82 PRKAB2 (0.43) TLR9TLR8TLR7JAK1JAK2

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-20240051970-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2024-02-15 — — US disclosed
EP-4263531-A2 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM Due, Inc. (US) 2023-10-25 — — EP disclosed
WO-2022133098-A2 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2022-06-23 — — 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-20240051970-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 TLR9 26/4885TLR8 58/4885TLR7 17/4885

“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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