SCHEMBL659906

SCHEMBL659906

Nc1ncc(-c2cnn(C3CCNCC3)c2)c2cc(-c3cccc4ccsc34)oc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 17/20 1.00
TAB1 Q15750 17/20 1.00
MAP4K3 Q8IVH8 3/20 0.67
KDR P35968 1/20 0.60
AURKB Q96GD4 1/20 0.60

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
Hydrochloric Acid SCHEMBL658455 0.99 MAP3K7 (0.98) MAP3K7TAB1MAP4K3KDRAURKB
SCHEMBL658604 0.90 MAP3K7 (0.82) MAP3K7TAB1MAP4K3KDRAURKB
SCHEMBL658603 0.90 MAP3K7 (0.82) MAP3K7TAB1MAP4K3KDRAURKB
SCHEMBL659252 0.89 MAP3K7 (0.81) MAP3K7TAB1KDRAURKB
SCHEMBL10271429 0.89 MAP3K7 (0.81) MAP3K7TAB1MAP4K3KDRAURKB
SCHEMBL658463 0.89 MAP3K7 (0.79) MAP3K7TAB1MAP4K3KDRAURKB
SCHEMBL660177 0.87 MAP3K7 (0.78) MAP3K7TAB1MAP4K3KDRAURKB
SCHEMBL659958 0.86 MAP3K7 (0.76) MAP3K7TAB1MAP4K3KDRAURKB
SCHEMBL661641 0.85 MAP3K7 (0.74) MAP3K7TAB1MAP4K3KDRAURKB
SCHEMBL660269 0.85 MAP3K7 (0.73) MAP3K7TAB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
US-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
US-8378104-B2 7-aminofuropyridine derivatives OSI Pharmaceuticals, LLC (US) 2013-02-19 US disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 US disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 US disclosed
US-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 US disclosed
WO-2011100502-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI Pharmaceuticals, LLC (US) 2011-08-18 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-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES MAP3K5, STK17A, MAPKAPK5 MAP3K7 5/4885TAB1 4/4885MAP4K3 40/4885

“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.