SCHEMBL6413590

SCHEMBL6413590

Nc1ccc(NC(c2ccncc2)C2CCNCC2)c(C(=O)Nc2ccc(Cl)cn2)c1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 2/20 0.45
▸ F10 P00742 15/20 0.44

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
SCHEMBL6415440 0.89 F10 (0.49) AKT1F10
SCHEMBL7360451 0.87 AKT1 (0.47) AKT1F10
Hydrochloric Acid SCHEMBL6712997 0.85 F10 (0.48) AKT1F10
Hydrochloric Acid SCHEMBL7455665 0.83 AKT1 (0.47) AKT1F10
SCHEMBL7447691 0.82 AKT1 (0.46) AKT1F10
SCHEMBL7357796 0.78 F10 (0.44) F10
SCHEMBL7362082 0.77 F10 (0.47) F10
SCHEMBL7360266 0.76 SMN1; SMN2 (0.42) AKT1F10
SCHEMBL7359916 0.74 F10 (0.44) AKT1F10
SCHEMBL7366704 0.74 ALDH1A1 (0.48) F10

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-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-20040029874-A1 Aromatic amides BEIGHT DOUGLAS WADE (US) 2004-02-12 — — 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 AKT1 2927/4885F10 12/4885
US-20050282862-A1 Aromatic amides F11, F12, F5 AKT1 2927/4885F10 12/4885

“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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