SCHEMBL28804386

SCHEMBL28804386

C=C(C)C(=O)ONC(=O)Nc1ccc(C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.50
TDP1 Q9NUW8 1/20 0.50
TP53 P04637 1/20 0.50
ALDH1A1 P00352 4/20 0.49
MAPT P10636 3/20 0.49
PTPN7 P35236 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
SMN1; SMN2 Q16637 6/20 0.46
NPC1 O15118 7/20 0.45
KIF11 P52732 1/20 0.45

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
SCHEMBL28804280 0.87 MAOA (0.51) RAB9ATP53ALDH1A1MAPTSMN1; SMN2
SCHEMBL28804345 0.87 SMN1; SMN2 (0.53) RAB9ATP53ALDH1A1MAPTHDAC3
SCHEMBL28804161 0.86 EPHX2 (0.50) RAB9ATDP1ALDH1A1MAPTSMN1; SMN2
SCHEMBL28804289 0.82 TIMP3 (0.47) PTPN7
SCHEMBL28804153 0.82 RAB9A (0.39) RAB9AMAPTSMN1; SMN2NPC1KDM4E
SCHEMBL28804383 0.82 KMT2A (0.61) PTPN7
SCHEMBL28804190 0.81 ALDH1A1 (0.48) RAB9AALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL28804185 0.79 MEN1 (0.42) RAB9ATP53MAPTHDAC3HDAC4
SCHEMBL28804296 0.78 GAA (0.51) TP53ALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL28904425 0.77 RAB9A (0.53) RAB9ATDP1TP53ALDH1A1MAPT

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