SCHEMBL24905685

SCHEMBL24905685

c1ccc(-c2cccc3nc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)ccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 6/20 0.36
TNF P01375 1/20 0.35
ACHE P22303 3/20 0.33
TDO2 P48775 1/20 0.33
TOP1 P11387 1/20 0.33
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPK1 P28482 2/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PTGS2 P35354 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
SCHEMBL18455628 0.89 ACACA (0.45) ACACAACHETOP1MEN1KMT2A
SCHEMBL24648286 0.88 ACACA (0.36) ACACAACHETDO2TOP1MEN1
SCHEMBL18455696 0.86 ACACA (0.46) ACACAACHETOP1MEN1KMT2A
SCHEMBL24647394 0.83 ACHE (0.45) ACACAACHETOP1HPGDLMNA
SCHEMBL24647396 0.83 ACACA (0.46) ACACAACHETOP1MEN1KMT2A
SCHEMBL21868294 0.82 ACACA (0.44) ACACAACHEMEN1KMT2AHPGD
SCHEMBL19760012 0.81 ACACA (0.39) ACACAACHEMEN1KMT2AHPGD
SCHEMBL21867870 0.81 ACACA (0.36) ACACAACHETDO2TOP1MEN1
SCHEMBL21868024 0.81 RAB9A (0.41) MEN1RAB9AKMT2AHPGDLMNA
SCHEMBL21868346 0.80 ACACA (0.42) ACACAACHETDO2TOP1MEN1

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-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed