SCHEMBL6014584

SCHEMBL6014584

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
IGF1R P08069 2/20 0.36
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
HDAC4 P56524 1/20 0.35
ALOX5 P09917 1/20 0.34
SPHK1 Q9NYA1 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
PTGIR P43119 2/20 0.34
SPHK2 Q9NRA0 1/20 0.34
F10 P00742 1/20 0.34
CPT2 P23786 1/20 0.34
CPT1A P50416 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 0.91 SLC6A2 (0.39) SLC6A2SLC6A4JAK2JAK1IGF1R
SCHEMBL2460497 0.86 JAK2 (0.40) JAK2JAK1IGF1RHDAC4MRGPRX4
SCHEMBL2459920 0.85 IGF1R (0.38) JAK2JAK1IGF1RHDAC4MRGPRX4
SCHEMBL5437301 0.82 IGF1R (0.40) JAK2JAK1IGF1RRAB9AHDAC4
SCHEMBL6014676 0.82 SPHK1 (0.39) JAK2JAK1IGF1RSPHK1MRGPRX4
SCHEMBL2460301 0.81 IGF1R (0.35) JAK2JAK1IGF1RALOX5
SCHEMBL2459426 0.80 BRD4 (0.36) JAK2JAK1HDAC4MRGPRX4
SCHEMBL2463487 0.79 PRMT5 (0.38) IGF1RRAB9AALOX5SPHK1SPHK2
SCHEMBL2459738 0.79 MAOB (0.37) JAK2JAK1IGF1RHDAC4MRGPRX4
SCHEMBL2462099 0.79 IGF1R (0.39) JAK2JAK1IGF1RALOX5SPHK1

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