SCHEMBL5790138

SCHEMBL5790138

CCC(c1cc2onc(C)c2c(=O)n1Cc1ccccc1)N(CCC#N)C(=O)c1ccccc1OC

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 18/20 0.45
GAA P10253 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL5784486 0.89 KIF11 (0.58) KIF11
SCHEMBL5790136 0.86 KIF11 (0.62) KIF11
SCHEMBL5787320 0.85 KIF11 (0.51) KIF11
SCHEMBL5785400 0.83 KIF11 (0.49) KIF11
SCHEMBL5789734 0.77 KIF11 (0.42) KIF11
SCHEMBL5783480 0.77 KIF11 (0.52) KIF11
SCHEMBL5784446 0.77 KIF11 (0.68) KIF11
SCHEMBL5899051 0.77 KIF11 (0.63) KIF11
SCHEMBL5787729 0.76 KIF11 (0.61) KIF11
SCHEMBL5801696 0.76 KIF11 (0.48) KIF11

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
EP-1628981-A2 BICYCLICPYRIMIDONES AND THEIR USE TO TREAT DISEASES Bristol-Myers Squibb Company (US) 2006-03-01 EP disclosed
WO-2004106492-A2 BICYCLICPYRIMIDONES AND THEIR USE TO TREAT DISEASES BRISTOL-MYERS SQUIBB COMPANY (US) 2004-12-09 WO disclosed