SCHEMBL5437301

SCHEMBL5437301

CNC(=O)C1CCCCC1C1=C2C=NC=C[N+]2(N)C(c2cccc(OCc3ccccc3)c2)=N1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 5/20 0.40
JAK2 O60674 2/20 0.38
JAK1 P23458 1/20 0.38
RAB9A P51151 1/20 0.36
HDAC4 P56524 1/20 0.36
F10 P00742 2/20 0.35
DHODH Q02127 2/20 0.34
ALOX5 P09917 1/20 0.34
BTK Q06187 1/20 0.34
SPHK1 Q9NYA1 1/20 0.34
JAK3 P52333 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
SCHEMBL5442115 0.92 SLC6A2 (0.39) IGF1RJAK2JAK1RAB9AHDAC4
SCHEMBL6014676 0.91 SPHK1 (0.39) IGF1RJAK2JAK1DHODHBTK
SCHEMBL2463470 0.86 IGF1R (0.51) IGF1RJAK2JAK1HDAC4F10
SCHEMBL6014584 0.82 SLC6A2 (0.39) IGF1RJAK2JAK1RAB9AHDAC4
SCHEMBL2458133 0.81 IGF1R (0.41) IGF1RJAK2JAK1HDAC4F10
SCHEMBL2459519 0.80 IGF1R (0.44) IGF1RJAK2JAK1RAB9AF10
SCHEMBL2457374 0.80 IGF1R (0.43) IGF1RJAK2JAK1F10
SCHEMBL2460551 0.80 IGF1R (0.48) IGF1RJAK2JAK1RAB9AF10
SCHEMBL2460832 0.79 IGF1R (0.51) IGF1RJAK2JAK1F10
SCHEMBL2461604 0.79 IGF1R (0.51) IGF1RJAK2JAK1RAB9AHDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007509060-A 2007-04-12 JP claimed
EP-1675860-A2 IMIDAZO[1,5-A]PYRAZINE TYROSINE KINASE INHIBITORS OSI Pharmaceuticals, Inc. (US) 2006-07-05 EP claimed
WO-2005037836-A2 IMIDAZO ‘1, 5 - A ! PYRAZINE TYROSINE KINASE INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2005-04-28 WO claimed