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Sugi Predict / Compounds / SCHEMBL1853175

SCHEMBL1853175

SCHEMBL1853175

COc1ccc2oc3c(=O)[nH]c(-c4ccc(NCC5CCN(C(=O)O)C(C(C)(C)C)C5)cc4Cl)nc3c2c1.COc1ccc2oc3c(=O)[nH]c(-c4ccc(NCC5CCN(C(=O)OC(C)(C)C)CC5)cc4Cl)nc3c2c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 14/20 0.50
▸ CSNK2B P67870 13/20 0.46
▸ CSNK2A2 P19784 11/20 0.46
▸ PIM3 Q86V86 11/20 0.46
▸ PIM2 Q9P1W9 11/20 0.46
▸ CDC7 O00311 3/20 0.41
▸ GPR119 Q8TDV5 3/20 0.37
▸ CSNK2A1 P68400 2/20 0.37
▸ TGFBR1 P36897 1/20 0.36
▸ PRMT5 O14744 1/20 0.36

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
SCHEMBL4106799 0.92 PIM1 (0.58) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL4278522 0.88 PIM1 (0.61) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1852809 0.78 PIM1 (0.78) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1854679 0.72 PIM1 (0.81) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL4106685 0.71 PIM1 (0.71) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1853349 0.68 PIM1 (1.00) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1850574 0.67 PIM1 (0.59) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1851020 0.67 PIM1 (0.59) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1851908 0.67 CSNK2A2 (0.76) PIM1CSNK2BCSNK2A2PIM3PIM2
SCHEMBL1849042 0.67 CSNK2B (0.76) 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