SCHEMBL658587

SCHEMBL658587

N#Cc1cc(-c2cc3c(-c4cnn(C5CCC(O)CC5)c4)cnc(N)c3o2)ccc1N

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 19/20 0.61
TAB1 Q15750 19/20 0.61
KDR P35968 1/20 0.59
AURKB Q96GD4 1/20 0.59
MAP4K3 Q8IVH8 1/20 0.55

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
SCHEMBL658586 1.00 MAP3K7 (0.61) MAP3K7TAB1KDRAURKBMAP4K3
SCHEMBL658202 0.87 MAP3K7 (0.81) MAP3K7TAB1
SCHEMBL661902 0.84 MAP3K7 (0.79) MAP3K7TAB1KDRAURKBMAP4K3
SCHEMBL661901 0.84 MAP3K7 (0.79) MAP3K7TAB1KDRAURKBMAP4K3
SCHEMBL10218772 0.82 MAP3K7 (0.60) MAP3K7TAB1KDRAURKB
SCHEMBL658928 0.81 MAP3K7 (0.59) MAP3K7TAB1KDRAURKBMAP4K3
SCHEMBL658929 0.81 MAP3K7 (0.59) MAP3K7TAB1KDRAURKBMAP4K3
SCHEMBL658782 0.81 MAP3K7 (0.59) MAP3K7TAB1KDRAURKBMAP4K3
SCHEMBL658781 0.81 MAP3K7 (0.59) MAP3K7TAB1KDRAURKBMAP4K3
SCHEMBL660747 0.80 MAP3K7 (0.58) MAP3K7TAB1KDRAURKBMAP4K3

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 2 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-20120046267-A1 7-AMINOFUROPYRIDINE DERIVATIVES OSI PHARMACEUTICALS, INC. 2012-02-23 US 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 4/4885KDR 3584/4885

“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.