SCHEMBL8399565

SCHEMBL8399565

O=C(O)Oc1cccc2c1-c1ccccc1C2CO

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 5/20 0.39
TOP1 P11387 1/20 0.38
FABP7 O15540 4/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
FABP3 P05413 3/20 0.36
NR3C1 P04150 1/20 0.35
KMT2A Q03164 1/20 0.35
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
KDM4E B2RXH2 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL8092638 0.81 HNF4A (0.50) FABP5FABP7L3MBTL1FABP3KMT2A
SCHEMBL27583741 0.76 KEAP1 (0.49) FABP5FABP7KMT2AKDM4EALDH1A1
SCHEMBL246689 0.73 HNF4A (0.46) FABP5TOP1FABP7TDP1L3MBTL1
SCHEMBL4624902 0.72 ALDH1A1 (0.39) FABP5FABP7L3MBTL1KMT2AKDM4E
Acetic Acid SCHEMBL28553657 0.72 POLB (0.48) FABP5FABP7KMT2AHRH3
SCHEMBL27961252 0.72 TOP1 (0.46) TOP1TDP1KMT2AKDM4ESMN1; SMN2
SCHEMBL3062707 0.72 HTR2A (0.47) FABP5FABP7KMT2AHRH3
SCHEMBL1639323 0.71 FABP3 (0.56) FABP5FABP7TDP1L3MBTL1FABP3
SCHEMBL30563023 0.71 FABP3 (0.56) FABP5FABP7TDP1L3MBTL1FABP3
SCHEMBL9449421 0.71 HTR2A (0.42) KMT2AHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672700-B1 PNA-synthesis using an aminoprotecting group which is labile against weak acids HOECHST AG (DE) 1999-06-02 EP disclosed
EP-0672700-A1 PNA-synthesis using an aminoprotecting group which is labile against weak acids HOECHST AKTIENGESELLSCHAFT (DE) 1995-09-20 EP disclosed