SCHEMBL9121310

SCHEMBL9121310

COc1ccc(Cl)cc1C(=O)NCCOc1ccc(CC2NC(=O)SC2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ DNMT3A Q9Y6K1 1/20 0.49
▸ LMNA P02545 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ NLRP3 Q96P20 3/20 0.47
▸ HDAC1 Q13547 2/20 0.46
▸ HDAC6 Q9UBN7 2/20 0.46

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
SCHEMBL8458179 0.84 KMT2A (0.55) KMT2AMEN1NPC1DNMT3ALMNA
SCHEMBL9121700 0.77 KMT2A (0.55) KMT2AMEN1NPC1LMNAMAPT
SCHEMBL9121706 0.77 KMT2A (0.55) KMT2AMEN1NPC1LMNAMAPT
SCHEMBL9121723 0.76 KMT2A (0.54) KMT2AMEN1NPC1DNMT3ALMNA
SCHEMBL9123712 0.75 KMT2A (0.64) KMT2AMEN1NPC1DNMT3ALMNA
SCHEMBL7898905 0.74 HTR1B (0.42) KMT2ALMNAMAPT
SCHEMBL8981902 0.73 DNMT3A (0.64) DNMT3ANLRP3HDAC1HDAC6
SCHEMBL8981978 0.72 DNMT3A (0.57) DNMT3ALMNANLRP3HDAC1HDAC6
SCHEMBL8981982 0.72 DNMT3A (0.57) DNMT3ALMNANLRP3HDAC1HDAC6
SCHEMBL8981980 0.72 DNMT3A (0.57) DNMT3ALMNANLRP3HDAC1HDAC6

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 4 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
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