SCHEMBL28804231

SCHEMBL28804231

C=CC(=O)ONC(=O)Nc1cccc2c(O)cccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.49
CDC25B P30305 4/20 0.47
CHEK1 O14757 1/20 0.46
DAPK3 O43293 1/20 0.46
PRKD3 O94806 1/20 0.46
MAP4K4 O95819 1/20 0.46
NTRK1 P04629 1/20 0.46
RET P07949 1/20 0.46
MET P08581 1/20 0.46
PIM1 P11309 1/20 0.46
FGFR1 P11362 1/20 0.46
PDGFRA P16234 1/20 0.46
LTK P29376 1/20 0.46
GRK5 P34947 1/20 0.46
MAPK8 P45983 1/20 0.46
CSNK1A1 P48729 1/20 0.46
CDK8 P49336 1/20 0.46
CLK2 P49760 1/20 0.46
GSK3A P49840 1/20 0.46
GSK3B P49841 1/20 0.46

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
SCHEMBL28804226 0.85 NPC1 (0.50) GAAKDM4EMAPTMEN1KMT2A
SCHEMBL3251658 0.80 TRPV1 (0.46) TRPV1CDC25BCHEK1DAPK3PRKD3
SCHEMBL28804292 0.80 TRPV1 (0.51) TRPV1CDC25BCHEK1DAPK3PRKD3
SCHEMBL3252175 0.78 TRPV1 (0.44) TRPV1CDC25BCHEK1DAPK3PRKD3
SCHEMBL14666462 0.77 PTPN1 (0.53) TRPV1CDC25BCHEK1DAPK3PRKD3
SCHEMBL3251137 0.75 ALDH1A1 (0.45) TRPV1CDC25BCHEK1DAPK3PRKD3
SCHEMBL20498498 0.73 TRPV1 (0.59) TRPV1CDC25BCHEK1DAPK3PRKD3
SCHEMBL28804177 0.73 MAOA (0.53) ALDH1A1GAAKDM4EMAPTMEN1
SCHEMBL10217894 0.73 KDM4E (0.71) TRPV1CHEK1DAPK3PRKD3MAP4K4
SCHEMBL28804238 0.73 HDAC1 (0.56) KDM4E

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
CN-109791361-B Positive lithographic printing plate precursor, method for producing same, and method for producing lithographic printing plate 富士胶片株式会社 2022-06-03 CN disclosed