SCHEMBL6108121

SCHEMBL6108121

COC(=O)CCC(=O)N1CCC(N(C)c2ccc(Cl)cc2C(=O)Nc2ccc(Cl)cn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.45
▸ F10 P00742 18/20 0.45
▸ KLKB1 P03952 2/20 0.45
▸ F2 P00734 2/20 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
SCHEMBL6107655 0.91 KCNH2 (0.47) KCNH2F10KLKB1
SCHEMBL6107026 0.89 F10 (0.48) KCNH2F10KLKB1F2
SCHEMBL6106754 0.87 F10 (0.47) KCNH2F10KLKB1F2
SCHEMBL6107173 0.86 F10 (0.50) KCNH2F10KLKB1
SCHEMBL6108596 0.84 F10 (0.52) KCNH2F10KLKB1F2
SCHEMBL6106432 0.83 F10 (0.52) KCNH2F10KLKB1
SCHEMBL6109873 0.83 NR3C1 (0.49) KCNH2F10KLKB1
SCHEMBL6107061 0.82 F10 (0.51) KCNH2F10KLKB1
SCHEMBL6109934 0.82 F10 (0.54) KCNH2F10KLKB1
SCHEMBL6110319 0.82 F10 (0.49) KCNH2F10KLKB1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7129245-B2 Anticoagulants which act selectively on factor Xa; fast acting; oral; do not interfere with lysis of blood clots ELI LILLY AND COMPANY (US) 2006-10-31 — — US disclosed
US-20050282862-A1 Aromatic amides BEIGHT DOUGLAS W 2005-12-22 — — US disclosed
EP-1140903-B1 AROMATIC AMIDES LILLY CO ELI (US) 2004-08-04 — — EP disclosed
US-6759414-B2 ANTICOAGULANTS WHICH ACT SELECTIVELY ON FACTOR XA; FAST ACTING; ORAL; DO NOT INTERFERE WITH LYSIS OF BLOOD CLOTS ELI LILLY AND COMPANY 2004-07-06 — — US disclosed
US-20040029874-A1 Aromatic amides BEIGHT DOUGLAS WADE (US) 2004-02-12 — — US disclosed
US-6635657-B1 Pyridine derivatives; anticoagulants ELI LILLY AND COMPANY 2003-10-21 — — US disclosed
EP-1140903-A1 AROMATIC AMIDES ELI LILLY AND COMPANY (US) 2001-10-10 — — EP disclosed
WO-2000039118-A1 AROMATIC AMIDES ELI LILLY AND COMPANY (US) 2000-07-06 — — 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 (2 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-20040029874-A1 Aromatic amides F11, F12, F5 KCNH2 1804/4885F10 12/4885KLKB1 458/4885
US-20050282862-A1 Aromatic amides F11, F12, F5 KCNH2 1804/4885F10 12/4885KLKB1 458/4885

“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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