SCHEMBL8921579

SCHEMBL8921579

O=C(O)CCCCCCOc1ccc(Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.61
ALB P02768 1/20 0.57
HRH3 Q9Y5N1 6/20 0.55
PLA2G4B P0C869 2/20 0.55
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
FFAR1 O14842 1/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51
HPGD P15428 2/20 0.51

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
SCHEMBL8922627 1.00 PPARA (0.61) PPARAALBHRH3PLA2G4BKMT2A
SCHEMBL28555169 1.00 PPARA (0.61) PPARAALBHRH3PLA2G4BKMT2A
SCHEMBL6545281 1.00 PPARA (0.61) PPARAALBHRH3PLA2G4BKMT2A
SCHEMBL28536384 0.98 PPARA (0.63) PPARAALBHRH3PLA2G4BKMT2A
SCHEMBL120716 0.93 KMT2A (0.58) PPARAKMT2AMEN1L3MBTL1FFAR1
SCHEMBL8922076 0.91 NR4A2 (0.61) PPARAALBHRH3FFAR1
SCHEMBL31448424 0.91 PPARA (0.71) PPARAALBPLA2G4BL3MBTL1FFAR1
SCHEMBL29141429 0.91 PPARA (0.71) PPARAALBPLA2G4BL3MBTL1FFAR1
SCHEMBL21073528 0.91 PPARA (0.71) PPARAALBPLA2G4BL3MBTL1FFAR1
SCHEMBL31448470 0.89 PPARA (0.73) PPARAALBPLA2G4BL3MBTL1FFAR1

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
CN-112624997-A Preparation method and application of 3-amino-2-oxazolidinone derivatives 中国人民解放军军事科学院军事医学研究院 2021-04-09 CN disclosed
US-5679801-A ANTIINFLAMMATORY AGENTS, ANTIASTHMATICS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-10-21 US disclosed
US-5242945-A Antiinflammatory AMERICAN HOME PRODUCTS CORPORATION (US) 1993-09-07 US disclosed
EP-0508690-A1 Tetronic and thiotetronic acid derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1992-10-14 EP disclosed