SCHEMBL9121700

SCHEMBL9121700

COc1ccc(Cl)cc1C(=O)NCCOc1ccc(/C=C2\SC(=O)NC2=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ PIM1 P11309 2/20 0.51
▸ PIM2 Q9P1W9 2/20 0.51
▸ CISD1 Q9NZ45 3/20 0.50
▸ HPGD P15428 4/20 0.49
▸ LMNA P02545 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ IGF1R P08069 1/20 0.49
▸ PDE4B Q07343 1/20 0.49
▸ PIM3 Q86V86 1/20 0.49
▸ CYP3A4 P08684 1/20 0.48
▸ ESRRA P11474 1/20 0.48
▸ NOD2 Q9HC29 1/20 0.48

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
SCHEMBL9121706 1.00 KMT2A (0.55) KMT2AMEN1NPC1PIM1PIM2
SCHEMBL9121723 0.90 KMT2A (0.54) KMT2AMEN1NPC1HPGDLMNA
SCHEMBL9123712 0.82 KMT2A (0.64) KMT2AMEN1NPC1HPGDLMNA
SCHEMBL8458179 0.78 KMT2A (0.55) KMT2AMEN1NPC1HPGDLMNA
SCHEMBL9121310 0.77 KMT2A (0.53) KMT2AMEN1NPC1HPGDLMNA
SCHEMBL9141936 0.76 HPGD (0.54) PIM1PIM2CISD1HPGD
SCHEMBL30973657 0.74 PIM1 (0.60) PIM1PIM2CISD1HPGD
SCHEMBL7457209 0.73 PIM1 (0.71) PIM1PIM2HPGDIGF1RPDE4B
SCHEMBL7457214 0.73 PIM1 (0.71) PIM1PIM2HPGDIGF1RPDE4B
SCHEMBL2733862 0.72 PIM1 (0.81) NPC1PIM1PIM2CISD1HPGD

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5478851-A Hyperglycemic agent and antilipemic agent BEECHAM GROUP PLC (GB) 1995-12-26 — — US claimed
EP-0555264-A1 NOVEL COMPOUNDS BEECHAM GROUP plc (GB) 1993-08-18 — — EP claimed
WO-1992007850-A1 NOVEL COMPOUNDS BEECHAM GROUP PLC (GB) 1992-05-14 — — WO claimed
US-5478851-A Hyperglycemic agent and antilipemic agent BEECHAM GROUP PLC (GB) 1995-12-26 — — US disclosed
EP-0555264-A1 NOVEL COMPOUNDS BEECHAM GROUP plc (GB) 1993-08-18 — — EP disclosed
WO-1992007850-A1 NOVEL COMPOUNDS BEECHAM GROUP PLC (GB) 1992-05-14 — — WO disclosed
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