SCHEMBL8974791

SCHEMBL8974791

O=C(O)OC(=O)c1cccc(Oc2ccccc2C(=O)OC(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.49
CTNNB1 P35222 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
HDAC8 Q9BY41 1/20 0.44
F10 P00742 2/20 0.44
MRGPRX4 Q96LA9 1/20 0.43
SCN1A P35498 1/20 0.42
SCN2A Q99250 1/20 0.42
SCN3A Q9NY46 1/20 0.42
F7 P08709 1/20 0.41
F3 P13726 1/20 0.41
KDM4E B2RXH2 2/20 0.41
ERCC5 P28715 1/20 0.41
FEN1 P39748 1/20 0.41
POLB P06746 1/20 0.41
PYGM P11217 1/20 0.41
SLC6A3 Q01959 1/20 0.41

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
SCHEMBL3953861 0.86 CTNNB1 (0.62) CTNNB1SMN1; SMN2MEN1MAPK1KMT2A
SCHEMBL9304626 0.84 AKR1C3 (0.61) AKR1C3MEN1KMT2AHDAC8MRGPRX4
2-Benzoylbenzoic Acid SCHEMBL27616765 0.83 AKR1C3 (0.51) AKR1C3CTNNB1SMN1; SMN2HDAC8POLB
SCHEMBL6937765 0.83 CTNNB1 (0.59) CTNNB1SMN1; SMN2MEN1MAPK1KMT2A
SCHEMBL352355 0.81 HTT (0.52) CTNNB1SMN1; SMN2MEN1MAPK1KMT2A
SCHEMBL6937759 0.79 CTNNB1 (0.67) CTNNB1SMN1; SMN2MEN1MAPK1KMT2A
SCHEMBL921873 0.78 AKR1C3 (0.69) AKR1C3CTNNB1KMT2AMRGPRX4F7
SCHEMBL10483665 0.78 CTNNB1 (0.57) CTNNB1SMN1; SMN2MEN1MAPK1KMT2A
SCHEMBL3762208 0.78 KDM4E (0.57) AKR1C3CTNNB1SMN1; SMN2MEN1KMT2A
SCHEMBL6938778 0.77 AKR1C3 (0.72) AKR1C3SMN1; SMN2MEN1KMT2AHDAC8

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-0349010-B1 Polyimide copolymers NIPPON STEEL CHEMICAL CO (JP) 1996-04-10 EP disclosed
US-5094919-A POLYIMIDE COPOLYMERS AND PROCESS FOR PREPARING THE SAME NIPPON STEEL CHEMICAL CO., LTD. (JP) 1992-03-10 US disclosed