SCHEMBL28804253

SCHEMBL28804253

C=C(C)C(=O)ONC(=O)Nc1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.56
MAPT P10636 1/20 0.56
GAA P10253 1/20 0.54
POLB P06746 3/20 0.52
GSK3B P49841 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
RAB9A P51151 5/20 0.52
KMT2A Q03164 4/20 0.52
EPHX1 P07099 1/20 0.51
ALDH1A1 P00352 3/20 0.51
MEN1 O00255 2/20 0.51
HPGD P15428 2/20 0.51
NPC1 O15118 3/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50

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
SCHEMBL28804292 0.85 TRPV1 (0.51) KDM4EMAPTGAAGSK3BRAB9A
SCHEMBL28804257 0.81 RAB9A (0.49) KDM4EMAPTGAAPOLBRAB9A
SCHEMBL28804193 0.81 POLB (0.54) MAPTGAAPOLBSMN1; SMN2RAB9A
SCHEMBL28804252 0.79 CA12 (0.48) KDM4EMAPTPOLBKMT2AALDH1A1
SCHEMBL1087936 0.78 EPHX1 (0.62) KDM4EMAPTPOLBGSK3BRAB9A
SCHEMBL30369173 0.77 RAB9A (0.61) KDM4EMAPTGAAPOLBRAB9A
SCHEMBL194202 0.77 RAB9A (0.61) KDM4EMAPTGAAPOLBRAB9A
SCHEMBL28804345 0.77 SMN1; SMN2 (0.53) KDM4EMAPTGAAPOLBSMN1; SMN2
Methacrylic Acid SCHEMBL28435297 0.77 RAB9A (0.56) KDM4EMAPTGAAPOLBGSK3B
SCHEMBL1276481 0.77 KDM4E (0.82) KDM4EMAPTGAAPOLBGSK3B

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