SCHEMBL9622934

SCHEMBL9622934

O=C(O)c1ccc(OCCOc2ccc(C(=O)O)cc2F)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.60
MAPK1 P28482 2/20 0.57
HTT P42858 2/20 0.57
LMNA P02545 1/20 0.57
RAB9A P51151 1/20 0.57
POLB P06746 1/20 0.56
CASP6 P55212 1/20 0.56
TP53 P04637 1/20 0.54
TSHR P16473 1/20 0.54
PLA2G4B P0C869 2/20 0.53
RARB P10826 4/20 0.50
MAPT P10636 1/20 0.50
NR4A2 P43354 2/20 0.49
ALDH1A1 P00352 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PLA2G4A P47712 1/20 0.48

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
SCHEMBL9623610 0.92 LMNA (0.66) MAPK1HTTLMNARAB9APOLB
SCHEMBL1749795 0.84 THRA (0.62) MAPK1HTTLMNARAB9ATP53
SCHEMBL2590444 0.84 HTT (0.66) MAPK1HTTLMNARAB9APOLB
SCHEMBL9623405 0.84 LMNA (0.57) MAPK1HTTLMNARAB9APOLB
SCHEMBL25317057 0.84 LMNA (0.60) MAPK1HTTLMNARAB9APOLB
SCHEMBL926838 0.84 LMNA (0.60) MAPK1HTTLMNARAB9APOLB
SCHEMBL15067061 0.83 LMNA (0.58) MAPK1HTTLMNARAB9APOLB
SCHEMBL1470380 0.83 LMNA (0.63) MAPK1HTTLMNARAB9APOLB
SCHEMBL24214163 0.82 LMNA (0.54) MAPK1HTTLMNARAB9APOLB
SCHEMBL13873581 0.81 POLB (0.68) PKMMAPK1HTTPOLBCASP6

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