SCHEMBL1558643

SCHEMBL1558643

Cc1cccc(-c2n[nH]c3cnc4ccc(-c5cc6cccnc6s5)cc4c23)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 4/20 0.39
▸ PIM3 Q86V86 1/20 0.39
▸ PIM2 Q9P1W9 1/20 0.39
▸ MAP2K4 P45985 3/20 0.36
▸ BCHE P06276 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ CLK4 Q9HAZ1 2/20 0.35
▸ MAP4K4 O95819 1/20 0.34
▸ WNT1 P04628 2/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ MAP3K5 Q99683 1/20 0.34
▸ PTGES O14684 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 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
SCHEMBL2398355 0.83 PDPK1 (0.40) PIM1PIM3PIM2CLK4LRRK2
SCHEMBL2396913 0.74 RIPK2 (0.39) PIM1MAP2K4BCHEACHECLK4
SCHEMBL1559214 0.74 MAPK10 (0.46) CLK4MAP4K4LRRK2KDM4EMEN1
SCHEMBL2396142 0.73 PIM1 (0.38) PIM1MAP2K4CLK4MAP4K4MAP3K5
SCHEMBL1559198 0.73 PDPK1 (0.46) MAP2K4CLK4MAP4K4LRRK2KDM4E
SCHEMBL1558709 0.73 NPBWR1 (0.46) ACHEMAP4K4MEN1ALDH1A1LMNA
SCHEMBL1559133 0.70 MAP3K5 (0.40) PIM1MAP4K4MAP3K5LRRK2KDM4E
SCHEMBL1559354 0.70 PIM1 (0.58) PIM1PIM3PIM2MAP2K4CLK4
SCHEMBL2395253 0.70 DYRK1A (0.46) PIM1WNT1LRRK2CLK2CLK3
SCHEMBL1558243 0.70 MTOR (0.36) PIM1PIM3PIM2CLK4LRRK2

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
EP-2303890-A2 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS Progenics Pharmaceuticals, Inc. (US) 2011-04-06 — — EP disclosed
WO-2009155527-A9 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. (US) 2010-05-06 — — WO disclosed
WO-2009155527-A2 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. (US) 2009-12-23 — — WO disclosed
Send feedback