SCHEMBL9623199

SCHEMBL9623199

O=C(O)c1cc(Br)c(OC(CCCOc2ccccc2Br)C(=O)O)c(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.43
PPARG P37231 2/20 0.41
PTGES O14684 1/20 0.41
ALOX5 P09917 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PTPN1 P18031 5/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 2/20 0.36
LMNA P02545 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL9623912 0.88 FOLH1 (0.47) FOLH1PPARGPTGESALOX5PTPN1
SCHEMBL9623316 0.87 PPARA (0.46) FOLH1PPARGPTGESALOX5KDM4E
SCHEMBL9623562 0.85 PPARG (0.39) FOLH1PPARGPTGESALOX5KDM4E
SCHEMBL9623393 0.81 MRGPRX4 (0.46) FOLH1PPARGPTGESALOX5KDM4E
SCHEMBL9623483 0.79 MEN1 (0.46) FOLH1PPARGPTGESALOX5ALDH1A1
SCHEMBL9623613 0.76 FOLH1 (0.51) FOLH1PPARGPTGESALOX5SMN1; SMN2
SCHEMBL9623612 0.73 FOLH1 (0.47) FOLH1PPARGPTGESALOX5PPARA
SCHEMBL9623617 0.73 FOLH1 (0.39) FOLH1PPARGPTGESALOX5PTPN1
SCHEMBL9623654 0.71 FOLH1 (0.47) FOLH1PPARGPTGESALOX5KDM4E
SCHEMBL9622907 0.71 PLAU (0.51) FOLH1PPARGPTGESALOX5NPC1

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