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SCHEMBL1855808

SCHEMBL1855808

O=C(COc1cccc(-c2nc3c(oc4ccc(Br)cc43)c(=O)[nH]2)c1)NCC1CC1.O=C(COc1cccc(-c2nc3c(oc4ccc(Br)cc43)c(=O)[nH]2)c1)NCC1CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 19/20 0.55
▸ CSNK2B P67870 19/20 0.55
▸ CSNK2A2 P19784 14/20 0.55
▸ PIM3 Q86V86 13/20 0.55
▸ PIM2 Q9P1W9 13/20 0.55
▸ CDC7 O00311 7/20 0.46
▸ CSNK2A1 P68400 7/20 0.46
▸ CYP1A2 P05177 1/20 0.44

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
SCHEMBL4107599 1.00 PIM1 (0.55) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL12661151 0.91 PIM1 (0.44) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL13650763 0.90 PIM1 (0.55) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1855811 0.87 PIM1 (0.55) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL13787060 0.81 MEN1 (0.41) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1849708 0.75 CSNK2B (0.60) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1853973 0.75 CSNK2B (0.59) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1853595 0.74 CSNK2B (0.53) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1850867 0.73 CSNK2B (0.62) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1851322 0.73 CSNK2B (0.70) PIM1CSNK2BCSNK2A2PIM3PIM2

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-2097419-B1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS INC (US) 2011-05-25 — — EP disclosed