SCHEMBL10752154

SCHEMBL10752154

C=C(C)C(=O)Sc1ccc2ccccc2c1N(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NCEH1 Q6PIU2 9/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 1/20 0.36
LMNA P02545 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
MAOB P27338 1/20 0.33
CNR2 P34972 2/20 0.32
PRKDC P78527 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NOX1 Q9Y5S8 1/20 0.32

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
SCHEMBL27233191 0.81 USP2 (0.39) ALDH1A1MAPTHPGDSLC22A12MAOB
SCHEMBL10752579 0.79 POLB (0.42) NCEH1ALDH1A1MAPTHPGDLMNA
SCHEMBL4830564 0.79 ALDH1A1 (0.40) ALDH1A1MAPTHPGDLMNAKDM4E
SCHEMBL10750350 0.77 HPGD (0.43) ALDH1A1MAPTHPGDLMNAKDM4E
SCHEMBL10752265 0.77 SLC22A12 (0.52) ALDH1A1MAPTHPGDSLC22A12KDM4E
SCHEMBL10748356 0.74 MAPT (0.44) ALDH1A1MAPTLMNAPRKDCKDM4E
SCHEMBL1803486 0.72 CA12 (0.44) ALDH1A1MAPTHPGDLMNAKDM4E
SCHEMBL27233193 0.71 CA12 (0.36) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL2209411 0.68 CA12 (0.40) ALDH1A1MAPTHPGDKDM4ERAB9A
SCHEMBL29223852 0.67 WDR5 (0.59) NCEH1ALDH1A1HPGDLMNAKDM4E

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-4654431-A Photopolymerizable thioacrylate monomers EASTMAN KODAK COMPANY (US) 1987-03-31 US disclosed