SCHEMBL657328

SCHEMBL657328

Nc1ncc(I)c2cc(-c3cccc4cnccc34)oc12

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 18/20 0.47
TAB1 Q15750 18/20 0.47
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDR P35968 2/20 0.40
AURKB Q96GD4 2/20 0.40
IKBKE Q14164 1/20 0.38
TBK1 Q9UHD2 1/20 0.38

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
SCHEMBL657881 0.85 MAP3K7 (0.38) MAP3K7TAB1KDRAURKB
SCHEMBL660235 0.81 LMNA (0.44) MAP3K7TAB1LMNACYP1A2CYP3A4
SCHEMBL658792 0.79 MAP3K7 (0.51) MAP3K7TAB1KDRAURKB
SCHEMBL658706 0.78 MAP3K7 (0.69) MAP3K7TAB1KDRAURKB
SCHEMBL661223 0.78 MAP3K7 (0.51) MAP3K7TAB1KDRAURKB
SCHEMBL658598 0.78 MAP3K7 (0.55) MAP3K7TAB1KDRAURKB
SCHEMBL659285 0.78 MAP3K7 (0.71) MAP3K7TAB1KDRAURKB
SCHEMBL658287 0.76 MAP3K7 (0.54) MAP3K7TAB1KDRAURKBIKBKE
SCHEMBL658942 0.76 MAP3K7 (0.54) MAP3K7TAB1KDRAURKB
SCHEMBL659703 0.76 MAP3K7 (0.54) MAP3K7TAB1KDRAURKB

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 4 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
EP-2534156-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI Pharmaceuticals, LLC (US) 2012-12-19 EP 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 4/4885LMNA 3566/4885

“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.