SCHEMBL14747509

SCHEMBL14747509

O=C(Nc1ccncc1F)c1cnc2c(Nc3ccon3)cc(CI)nn12

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 9/20 0.33
▸ PDE4D Q08499 5/20 0.33
▸ GAA P10253 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ATR Q13535 3/20 0.31
▸ ROCK2 O75116 4/20 0.31
▸ F9 P00740 1/20 0.31
▸ F10 P00742 1/20 0.31
▸ DYRK3 O43781 1/20 0.31
▸ LCK P06239 1/20 0.31
▸ CSF1R P07333 1/20 0.31
▸ LYN P07948 1/20 0.31
▸ KIT P10721 1/20 0.31
▸ FRK P42685 1/20 0.31
▸ PRKCD Q05655 1/20 0.31
▸ MAPK14 Q16539 1/20 0.31
▸ SRPK1 Q96SB4 1/20 0.31
▸ MAP3K20 Q9NYL2 1/20 0.31

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
SCHEMBL3722959 0.87 TYK2 (0.33) TYK2PDE4DGAASMN1; SMN2ATR
SCHEMBL13062521 0.87 ATR (0.35) TYK2PDE4DATRF10LCK
SCHEMBL13013466 0.81 TYK2 (0.42) TYK2PDE4D
SCHEMBL3730771 0.81 TYK2 (0.42) TYK2PDE4D
SCHEMBL3730769 0.81 TYK2 (0.42) TYK2PDE4D
SCHEMBL3719701 0.80 TYK2 (0.43) TYK2PDE4D
SCHEMBL13013461 0.80 TYK2 (0.43) TYK2PDE4D
SCHEMBL3719712 0.80 TYK2 (0.43) TYK2PDE4D
SCHEMBL3720955 0.74 TYK2 (0.38) TYK2PDE4DATRF10
SCHEMBL3719904 0.74 MEN1 (0.40) TYK2SMN1; SMN2

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
US-8389527-B2 Substituted imidazopyridazines useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-03-05 — — US disclosed
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