SCHEMBL9520645

SCHEMBL9520645

Cc1ccc(-c2nc(CCC(=O)c3ccc(C=C4SC(=O)NC4=O)cc3)c(C)o2)o1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 6/20 0.43
PIM2 Q9P1W9 5/20 0.40
HPGD P15428 4/20 0.40
HDAC4 P56524 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
AKR1B1 P15121 2/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
IGF1R P08069 1/20 0.38
MYC P01106 1/20 0.38
IL1RN P18510 1/20 0.38
ERAP1 Q9NZ08 1/20 0.38
PTGS2 P35354 2/20 0.38
GSK3B P49841 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
PIK3CA P42336 2/20 0.38
PIK3CG P48736 2/20 0.38
CISD1 Q9NZ45 2/20 0.37
MAOA P21397 1/20 0.37

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
SCHEMBL9520639 1.00 PIM1 (0.43) PIM1PIM2HPGDHDAC4MEN1
SCHEMBL9520097 0.86 KDM4E (0.45) PIM1PIM2HPGDPIK3CG
SCHEMBL9520104 0.86 KDM4E (0.45) PIM1PIM2HPGDPIK3CG
SCHEMBL9521137 0.86 PIM1 (0.49) PIM1PIM2HPGDHDAC4AKR1B1
SCHEMBL9521141 0.86 PIM1 (0.49) PIM1PIM2HPGDHDAC4AKR1B1
SCHEMBL9521889 0.82 PTPN1 (0.43) PIM1HPGDHDAC4MEN1KMT2A
SCHEMBL9521653 0.82 PIM1 (0.50) PIM1PIM2HDAC4CISD1
SCHEMBL9521885 0.82 PTPN1 (0.43) PIM1HPGDHDAC4MEN1KMT2A
SCHEMBL9521656 0.82 PIM1 (0.50) PIM1PIM2HDAC4CISD1
SCHEMBL9521783 0.82 ALDH1A1 (0.36) RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0332332-B1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1993-03-31 EP disclosed
US-5130379-A Anticholesterol agents and antidiabetic agents PFIZER INC. (US) 1992-07-14 US disclosed
US-5036079-A Anticholesterol PFIZER INC. (US) 1991-07-30 US disclosed
WO-1991003474-A1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1991-03-21 WO disclosed
EP-0332332-A1 Hypoglycemic thiazolidinedione derivatives PFIZER INC. (US) 1989-09-13 EP disclosed