SCHEMBL9309327

SCHEMBL9309327

O=C(O)c1cc(N2C(=O)C3=C(CCCC3)C2=O)ccc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 1/20 0.49
HIPK4 Q8NE63 1/20 0.49
SCN2A Q99250 1/20 0.49
PKM P14618 1/20 0.49
DUSP22 Q9NRW4 1/20 0.46
ACMSD Q8TDX5 4/20 0.44
TYMS P04818 1/20 0.44
KLKB1 P03952 1/20 0.44
CTSB P07858 1/20 0.44
MMP9 P14780 1/20 0.44
DNMT1 P26358 1/20 0.44
DNMT3B Q9UBC3 1/20 0.44
DNMT3L Q9UJW3 1/20 0.44
DNMT3A Q9Y6K1 1/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
PTGS2 P35354 2/20 0.43
CA12 O43570 1/20 0.43
ALOX5 P09917 1/20 0.43
CA7 P43166 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
SCHEMBL24939830 0.88 PIM3 (0.64) PIM3HIPK4SCN2APKMDUSP22
SCHEMBL8560334 0.84 TDP1 (0.50) PIM3HIPK4SCN2APKMCTSB
SCHEMBL24939668 0.81 PIM3 (0.44) PIM3HIPK4SCN2ATYMSCA1
SCHEMBL24939771 0.81 PIM3 (0.44) PIM3HIPK4SCN2ATYMS
SCHEMBL24939816 0.81 PIM3 (0.44) PIM3HIPK4SCN2ATYMSCA1
SCHEMBL24938791 0.81 TYMS (0.49) PIM3HIPK4SCN2ATYMSKLKB1
SCHEMBL9309272 0.80 CA12 (0.52) CA1CA2CA12CA7CA9
SCHEMBL9308287 0.80 PKM (0.61) PIM3HIPK4SCN2APKMDUSP22
SCHEMBL24939784 0.78 PIM3 (0.43) PIM3HIPK4SCN2ATYMS
SCHEMBL24939829 0.77 ALDH1A1 (0.47) PIM3HIPK4SCN2ATYMSPTGS2

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
US-5288694-A Herbicides BAYER ATKIENGESELLSCHAFT (DE) 1994-02-22 US disclosed
EP-0545167-A1 N-(4-hydroxyphenyl)-maleimides and N-(4-hydroxyphenyl)-tetrahydro-phthalimides and their use as herbicides BAYER AG (DE) 1993-06-09 EP disclosed