SCHEMBL8458179

SCHEMBL8458179

COc1ccc(Cl)cc1C(=O)NCCOc1ccc(CC2SC(=O)NC2=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ FFAR1 O14842 5/20 0.52
▸ PPARG P37231 5/20 0.51
▸ DNMT3A Q9Y6K1 1/20 0.51
▸ MPC2 O95563 1/20 0.50
▸ CYP2C8 P10632 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ LMNA P02545 2/20 0.49
▸ MAPT P10636 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ HDAC1 Q13547 1/20 0.48
▸ HDAC6 Q9UBN7 1/20 0.48
▸ NLRP3 Q96P20 3/20 0.47
▸ PTPN1 P18031 1/20 0.47
▸ CA2 P00918 1/20 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
SCHEMBL8981902 0.90 DNMT3A (0.64) DNMT3AHDAC1HDAC6NLRP3
SCHEMBL8981982 0.88 DNMT3A (0.57) DNMT3ALMNAHDAC1HDAC6NLRP3
SCHEMBL8981978 0.88 DNMT3A (0.57) DNMT3ALMNAHDAC1HDAC6NLRP3
SCHEMBL8981980 0.88 DNMT3A (0.57) DNMT3ALMNAHDAC1HDAC6NLRP3
SCHEMBL8981845 0.88 LMNA (0.52) PPARGDNMT3ALMNAMAPTHPGD
SCHEMBL8981831 0.88 LMNA (0.52) PPARGDNMT3ALMNAMAPTHPGD
SCHEMBL8981839 0.88 LMNA (0.52) PPARGDNMT3ALMNAMAPTHPGD
SCHEMBL8981741 0.85 LMNA (0.49) FFAR1PPARGDNMT3AMPC2CYP2C8
SCHEMBL8981737 0.85 LMNA (0.49) FFAR1PPARGDNMT3AMPC2CYP2C8
SCHEMBL8981731 0.85 LMNA (0.49) FFAR1PPARGDNMT3AMPC2CYP2C8

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
WO-1999059586-A1 THIAZOLIDINE AND OXAZOLIDINE DERIVATIVES FOR THE TREATMENT OF ACUTE MYOCARDIAL INFARCTION AND INHIBITION OF CARDIOMYOCYTE APOPTOSIS REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-11-25 — — WO claimed
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
WO-1999059586-A1 THIAZOLIDINE AND OXAZOLIDINE DERIVATIVES FOR THE TREATMENT OF ACUTE MYOCARDIAL INFARCTION AND INHIBITION OF CARDIOMYOCYTE APOPTOSIS REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-11-25 — — WO disclosed
US-5478851-A Hyperglycemic agent and antilipemic agent BEECHAM GROUP PLC (GB) 1995-12-26 — — US disclosed
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