SCHEMBL16784348

SCHEMBL16784348

Nc1cccc(-c2cnn3ccc(Nc4ccc(N5CCOCC5)cc4)nc23)c1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FYN P06241 5/20 0.66
JAK2 O60674 3/20 0.53
PIM1 P11309 8/20 0.52
RET P07949 1/20 0.48
ITK Q08881 1/20 0.47
PIM2 Q9P1W9 2/20 0.47
JAK3 P52333 2/20 0.46
PTK2 Q05397 1/20 0.46
SLC2A1 P11166 1/20 0.45
PIK3CG P48736 1/20 0.45

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
SCHEMBL4595046 0.89 FYN (0.66) FYNPIM1RETPIM2SLC2A1
SCHEMBL4337397 0.86 PIK3CG (0.62) FYNJAK2PIM1RETJAK3
SCHEMBL4335453 0.86 FYN (0.82) FYNJAK2PIM1PIM2JAK3
SCHEMBL4338182 0.85 FYN (0.69) FYNPIM1RETPIM2PIK3CG
SCHEMBL4325795 0.84 JAK3 (0.66) FYNJAK2PIM1JAK3PTK2
SCHEMBL4692793 0.84 FYN (0.65) FYNJAK2PIM1RETJAK3
SCHEMBL4340112 0.84 FYN (0.67) FYNJAK2PIM1RETJAK3
SCHEMBL4338231 0.84 PIM1 (0.67) FYNPIM1PIM2
SCHEMBL102515 0.84 FYN (0.62) FYNJAK2PIM1RETJAK3
SCHEMBL4338988 0.84 BRAF (0.64) FYNJAK2RETJAK3SLC2A1

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-2086979-B1 IMIDAZO[1,2-B]PYRIDAZINE AND PYRAZOLO[1,5-A]PYRIMIDINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS TOLERO PHARMACEUTICALS INC (US) 2015-06-03 EP disclosed