SCHEMBL28075111

SCHEMBL28075111

CCCCCC(O)O.COC(=O)CCCCC(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.53
PPARG P37231 2/20 0.52
TSHR P16473 1/20 0.52
PPARA Q07869 1/20 0.49
MAPT P10636 1/20 0.49
LMNA P02545 3/20 0.48
POLB P06746 1/20 0.47
POLA1 P09884 1/20 0.47
FFAR4 Q5NUL3 1/20 0.47
FFAR1 O14842 1/20 0.47
DGKA P23743 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
DUSP3 P51452 1/20 0.46
ZDHHC7 Q9NXF8 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
SCHEMBL15943067 0.92 TSHR (0.61) L3MBTL1PPARGTSHRPPARALMNA
SCHEMBL28690397 0.90 TSHR (0.58) L3MBTL1PPARGTSHRPPARAMAPT
SCHEMBL16675687 0.90 TSHR (0.58) L3MBTL1PPARGTSHRPPARAMAPT
SCHEMBL16845263 0.90 TSHR (0.58) L3MBTL1PPARGTSHRPPARAMAPT
SCHEMBL28672736 0.90 TSHR (0.58) L3MBTL1PPARGTSHRPPARAMAPT
SCHEMBL16845300 0.87 FFAR4 (0.65) L3MBTL1PPARGMAPTLMNAFFAR4
SCHEMBL18823717 0.87 FFAR4 (0.65) L3MBTL1PPARGMAPTLMNAFFAR4
SCHEMBL1985687 0.87 MEN1 (0.57) L3MBTL1PPARGTSHRPPARAMAPT
SCHEMBL13219941 0.87 FFAR4 (0.65) L3MBTL1PPARGMAPTLMNAFFAR4
SCHEMBL8814461 0.87 FFAR4 (0.65) L3MBTL1PPARGMAPTLMNAFFAR4

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
CN-105727962-A Catalyst for preparing hexanediol from dimethyl adipate and preparation method and application thereof 上海华峰新材料研发科技有限公司 2016-07-06 CN disclosed