SCHEMBL9623318

SCHEMBL9623318

Cc1ccccc1OCCCC(Oc1ccc(C(=O)O)cc1C)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.49
RXRA P19793 1/20 0.48
RXRB P28702 1/20 0.48
RXRG P48443 1/20 0.48
PPARG P37231 2/20 0.46
PPARA Q07869 2/20 0.46
FOLH1 Q04609 1/20 0.44
NPC1 O15118 1/20 0.44
MITF O75030 1/20 0.44
NFKB1 P19838 1/20 0.44
RAB9A P51151 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
PAX8 Q06710 1/20 0.44
KLF5 Q13887 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL9623316 0.79 PPARA (0.46) PPARGPPARAFOLH1NPC1RAB9A
SCHEMBL9623914 0.79 PPARG (0.51) TDP1PPARGPPARAFOLH1RAB9A
SCHEMBL9623931 0.79 MEN1 (0.48) TDP1RXRARXRBPPARGPPARA
SCHEMBL9623616 0.79 RXRA (0.51) TDP1RXRARXRBRXRGPPARG
SCHEMBL5268934 0.77 PPARG (0.46) TDP1PPARGPPARAKDM4EKMT2A
SCHEMBL9623925 0.76 POLB (0.55) MRGPRX4POLBCASP6
SCHEMBL9622883 0.75 FOLH1 (0.51) TDP1PPARGPPARAFOLH1RAB9A
SCHEMBL9623613 0.75 FOLH1 (0.51) TDP1PPARGPPARAFOLH1SMN1; SMN2
SCHEMBL14565994 0.75 CTRC (0.50) TDP1PPARGPPARAKDM4EALDH1A1
SCHEMBL27373603 0.75 PDE4A (0.65) RXRARXRBRXRGHTTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0212944-B1 MELT-PROCESSABLE AROMATIC COPOLYESTER Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1992-04-08 EP disclosed
US-4746721-A ENGINEERING PLASTICS KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 1988-05-24 US disclosed
EP-0212944-A2 Melt-processable aromatic copolyester Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) 1987-03-04 EP disclosed