SCHEMBL6974450

SCHEMBL6974450

CCN(CCOc1ccc(/C=C2/SC(=O)NC2=O)cc1)CC1(C)CCc2c(C)c(OCc3ccccc3)c(C)c(C)c2O1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.49
PTPN1 P18031 2/20 0.49
MAOA P21397 2/20 0.49
MAOB P27338 2/20 0.49
POLB P06746 1/20 0.49
PPARG P37231 3/20 0.45
MMP3 P08254 1/20 0.43
MMP13 P45452 1/20 0.43
PIM1 P11309 1/20 0.42
PIM2 Q9P1W9 1/20 0.42
CISD1 Q9NZ45 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL6974454 1.00 HPGD (0.49) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL6967865 0.91 HPGD (0.51) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL6967873 0.91 HPGD (0.51) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL6976820 0.89 CYP1A2 (0.40) MAOAMAOBPPARGMEN1KMT2A
SCHEMBL6967821 0.88 HPGD (0.50) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL6979687 0.88 HPGD (0.50) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL6979068 0.87 PIM1 (0.46) HPGDPPARGPIM1PIM2CISD1
SCHEMBL6976240 0.87 PIM1 (0.46) HPGDPPARGPIM1PIM2CISD1
SCHEMBL13256853 0.86 HPGD (0.57) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL7829571 0.86 HPGD (0.57) HPGDPTPN1MAOAMAOBPOLB

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-0801063-B1 Thiazolidinedione derivatives having antidiabetic, hypolipidaemic, antihypertensive properties, process for their preparation and pharmaceutical compositions containing them REDDYS LAB LTD DR (IN) 2003-01-15 EP claimed