SCHEMBL8266364

SCHEMBL8266364

CC(C)(C)c1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)Nc2ccc(F)cn2)c(OC2CCNCC2)c1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 17/20 0.51
▸ IRAK4 Q9NWZ3 2/20 0.44
▸ KCNH2 Q12809 2/20 0.43
▸ IRAK1 P51617 1/20 0.43
▸ GPR6 P46095 1/20 0.42

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
Trifluoroacetic Acid SCHEMBL3163883 0.96 F10 (0.48) F10IRAK4KCNH2IRAK1GPR6
SCHEMBL3152348 0.94 F10 (0.51) F10IRAK4KCNH2GPR6
SCHEMBL13403765 0.94 F10 (0.53) F10KCNH2
Hydrochloric Acid SCHEMBL3151212 0.93 F10 (0.51) F10IRAK4KCNH2GPR6
Hydrochloric Acid SCHEMBL3161264 0.93 F10 (0.52) F10KCNH2
SCHEMBL8265959 0.91 F10 (0.51) F10IRAK4KCNH2IRAK1
Hydrochloric Acid SCHEMBL3156390 0.91 F10 (0.50) F10IRAK4KCNH2IRAK1
SCHEMBL13403812 0.91 F10 (0.45) F10IRAK4IRAK1GPR6
Hydrochloric Acid SCHEMBL3151797 0.90 GPR6 (0.44) F10IRAK4IRAK1GPR6
SCHEMBL8265073 0.89 F10 (0.50) F10IRAK4KCNH2IRAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700628-B2 Aromatic ether derivatives useful as thrombin inhibitors ELI LILLY AND COMPANY (US) 2010-04-20 — — US disclosed
US-7700628-B2 Aromatic ether derivatives useful as thrombin inhibitors ELI LILLY AND COMPANY (US) 2010-04-20 — — US disclosed
US-20090227566-A1 AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS ELI LILLY AND COMPANY 2009-09-10 — — US disclosed
US-20090227566-A1 AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS ELI LILLY AND COMPANY 2009-09-10 — — US disclosed
WO-2006057845-A1 AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS ELI LILLY AND COMPANY (US) 2006-06-01 — — 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-20090227566-A1 AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS TFPI, F2, F11 F10 15/4885IRAK4 2856/4885KCNH2 2712/4885

“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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