SCHEMBL2460657

SCHEMBL2460657

COC(=O)C1(C(N)=O)CCC(C2=C3C=NC=C[N+]3(N)C(c3cccc(OCc4ccccc4)c3)=N2)CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 4/20 0.39
IGF1R P08069 5/20 0.35
JAK2 O60674 2/20 0.34
JAK1 P23458 1/20 0.34
KCNH2 Q12809 1/20 0.34
BTK Q06187 1/20 0.33
HDAC4 P56524 1/20 0.33
JAK3 P52333 1/20 0.33
F10 P00742 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33

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
SCHEMBL2460247 0.93 JAK2 (0.37) ADAM17IGF1RJAK2KCNH2BTK
SCHEMBL2462980 0.91 ADAM17 (0.33) ADAM17IGF1RJAK2JAK1KCNH2
SCHEMBL2457720 0.86 IGF1R (0.34) ADAM17IGF1RJAK2JAK1KCNH2
SCHEMBL2458133 0.86 IGF1R (0.41) IGF1RJAK2JAK1HDAC4F10
SCHEMBL2460551 0.84 IGF1R (0.48) IGF1RJAK2JAK1KCNH2BTK
SCHEMBL5115303 0.84 IGF1R (0.35) ADAM17IGF1RJAK2JAK1KCNH2
SCHEMBL2460164 0.84 ACACB (0.35) ADAM17IGF1RJAK2JAK1F10
SCHEMBL2457374 0.84 IGF1R (0.43) IGF1RJAK2JAK1KCNH2F10
SCHEMBL2463470 0.83 IGF1R (0.51) IGF1RJAK2JAK1HDAC4F10
SCHEMBL5109184 0.83 IGF1R (0.34) ADAM17IGF1RJAK2JAK1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1675860-B1 IMIDAZO[1,5-A]PYRAZINES AS TYROSINE KINASE INHIBITORS OSI PHARM INC (US) 2011-09-21 EP disclosed