SCHEMBL6108331

SCHEMBL6108331

CN(c1ccc(N)cc1C(=O)Nc1ccc(Cl)cn1)C1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 4/20 0.46
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ TP53 P04637 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ WNT3A P56704 1/20 0.42
▸ F10 P00742 3/20 0.42
▸ DDB1 Q16531 1/20 0.42
▸ CRBN Q96SW2 1/20 0.42
▸ USP2 O75604 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ STS P08842 1/20 0.41
▸ USP30 Q70CQ3 1/20 0.40
▸ GPR119 Q8TDV5 1/20 0.40
▸ CNR1 P21554 2/20 0.40
▸ KCNH2 Q12809 1/20 0.39
▸ CNR2 P34972 1/20 0.39

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
SCHEMBL6109873 0.93 NR3C1 (0.49) NR3C1MEN1KMT2ATP53MAPT
SCHEMBL6107131 0.90 NR3C1 (0.46) NR3C1MEN1KMT2ATP53MAPT
SCHEMBL5758729 0.83 MEN1 (0.48) NR3C1MEN1KMT2ATP53MAPT
SCHEMBL6107465 0.82 F10 (0.42) F10USP30
SCHEMBL6108337 0.81 F10 (0.47) NR3C1TP53MAPTTHRBWNT3A
SCHEMBL6107173 0.81 F10 (0.50) F10USP30KCNH2
SCHEMBL6106432 0.78 F10 (0.52) F10KCNH2
SCHEMBL6107655 0.77 KCNH2 (0.47) F10KCNH2
SCHEMBL6109809 0.77 F10 (0.54) F10USP30KCNH2
SCHEMBL6108121 0.77 KCNH2 (0.45) F10KCNH2

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 NR3C1 4435/4885MEN1 1626/4885KMT2A 1697/4885
US-20050282862-A1 Aromatic amides F11, F12, F5 NR3C1 4435/4885MEN1 1626/4885KMT2A 1697/4885

“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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