SCHEMBL9767684

SCHEMBL9767684

C=CCCCCCCCCCCCCCCCOC(=O)c1cc(C(=O)O)ccc1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
HTT P42858 3/20 0.48
KDM4E B2RXH2 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
TSHR P16473 2/20 0.39
LMNA P02545 2/20 0.39
HDAC6 Q9UBN7 1/20 0.38
PTPN11 Q06124 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
MAPT P10636 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PPARA Q07869 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
SCHEMBL6900919 0.89 TDP1 (0.50) ALDH1A1HTTKDM4ETDP1POLB
SCHEMBL9767717 0.87 ALDH1A1 (0.42) ALDH1A1L3MBTL1HTTKDM4ETDP1
SCHEMBL5269420 0.85 TSHR (0.49) ALDH1A1L3MBTL1HTTKDM4ETDP1
SCHEMBL3651606 0.85 HTT (0.43) ALDH1A1L3MBTL1HTTKDM4ETDP1
SCHEMBL29220154 0.85 ALDH1A1 (0.56) ALDH1A1L3MBTL1HTTKDM4ETDP1
SCHEMBL18117698 0.85 ALDH1A1 (0.56) ALDH1A1L3MBTL1HTTKDM4ETDP1
SCHEMBL29220249 0.85 ALDH1A1 (0.56) ALDH1A1L3MBTL1HTTKDM4ETDP1
SCHEMBL6509552 0.85 ALDH1A1 (0.56) ALDH1A1L3MBTL1HTTKDM4ETDP1
SCHEMBL14725890 0.83 HDAC6 (0.41) ALDH1A1L3MBTL1HTTTDP1TSHR
SCHEMBL6516856 0.83 TSHR (0.55) ALDH1A1L3MBTL1KDM4ETDP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5043248-A Photosensitive thin films KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-08-27 US disclosed