SCHEMBL9375804

SCHEMBL9375804

O=C1NC(=O)/C(=C\c2ccc(C(=O)CCc3ccccc3)nc2)S1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 15/20 0.62
PTPN1 P18031 2/20 0.54
MAOA P21397 2/20 0.54
MAOB P27338 2/20 0.54
POLB P06746 1/20 0.54
PIM1 P11309 1/20 0.53
PIM3 Q86V86 1/20 0.53
PIM2 Q9P1W9 1/20 0.53
NPC1 O15118 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52

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
SCHEMBL9375807 1.00 HPGD (0.62) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL9379554 0.80 HPGD (0.54) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL9379550 0.80 HPGD (0.54) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL9372044 0.78 HPGD (0.70) HPGDPIM1PIM3PIM2
SCHEMBL9372040 0.78 HPGD (0.70) HPGDPIM1PIM3PIM2
SCHEMBL20637539 0.77 HPGD (1.00) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL19119626 0.77 HPGD (1.00) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL9371454 0.76 ALDH1A1 (0.46) NPC1RAB9A
SCHEMBL1300347 0.73 HPGD (1.00) HPGDPTPN1MAOAMAOBPOLB
SCHEMBL1300345 0.73 HPGD (1.00) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0332331-B1 Thiazolidinedione hypoglycemic agents PFIZER (US) 1994-02-09 EP disclosed
US-5223522-A Anticholesterol agents PFIZER INC. (US) 1993-06-29 US disclosed
US-5120754-A Anticholesterol and antidiabetic agents PFIZER INC. (US) 1992-06-09 US disclosed
US-5061717-A ANTICHOLESTEROL AGENTS PFIZER INC. (US) 1991-10-29 US disclosed
WO-1989008650-A1 THIAZOLIDINEDIONE HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1989-09-21 WO disclosed
EP-0332331-A2 Thiazolidinedione hypoglycemic agents PFIZER INC. (US) 1989-09-13 EP disclosed