SCHEMBL20274635

SCHEMBL20274635

C=CCn1c(CCCCCCCC)c(C)c(=O)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
ALDH1A1 P00352 4/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
KDM4C Q9H3R0 1/20 0.41
OXER1 Q8TDS5 1/20 0.41
RORA P35398 2/20 0.40
RORC P51449 2/20 0.40
RORB Q92753 2/20 0.40
ATM Q13315 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
HCRTR1 O43613 1/20 0.40
KDM4E B2RXH2 3/20 0.40
PGR P06401 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 2/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SLC6A4 P31645 2/20 0.39

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
SCHEMBL17400316 0.86 ALDH1A1 (0.55) LMNAALDH1A1OXER1RORARORC
SCHEMBL20274427 0.84 OXER1 (0.43) LMNAALDH1A1OXER1RORARORC
SCHEMBL20274448 0.84 OXER1 (0.41) LMNAALDH1A1OXER1RORARORC
SCHEMBL17400314 0.84 OXER1 (0.46) LMNAALDH1A1OXER1RORARORC
SCHEMBL20274601 0.84 ALDH1A1 (0.45) LMNAALDH1A1OXER1RORARORC
SCHEMBL17400311 0.84 ALDH1A1 (0.45) LMNAALDH1A1OXER1RORARORC
SCHEMBL17400303 0.81 ALDH1A1 (0.43) LMNAALDH1A1OXER1RORARORC
SCHEMBL20274400 0.81 ALDH1A1 (0.46) LMNAALDH1A1OXER1RORARORC
SCHEMBL17400307 0.81 ALDH1A1 (0.40) LMNAALDH1A1OXER1RORARORC
SCHEMBL20274429 0.81 KDM4E (0.48) LMNAALDH1A1OXER1RORARORC

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
EP-3336080-A1 NOVEL COMPOUND, PRODUCTION METHOD THEREFOR, AND USE OF SAID COMPOUND Microbial Chemistry Research Foundation (JP) 2018-06-20 EP disclosed