SCHEMBL26949641

SCHEMBL26949641

c1cc(-c2c3ccccc3c(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)c3ccccc23)c2cc(-c3ccc4cccc(-c5c6ccccc6c(-c6ccc7oc8ccccc8c7c6)c6ccccc56)c4c3)ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 5/20 0.40
MAPT P10636 4/20 0.40
HPGD P15428 4/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
PLA2G2A P14555 3/20 0.38
PLA2G4A P47712 3/20 0.38
ALOX5 P09917 1/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GLA P06280 2/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL26949401 0.97 KDM4E (0.41) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL26949644 0.96 CASP3 (0.38) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL21984648 0.96 PLA2G2A (0.43) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL23266783 0.96 PLA2G2A (0.43) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL26949408 0.96 PLA2G2A (0.41) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL26949482 0.96 KDM4E (0.39) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL26949400 0.96 MAPT (0.41) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL24285568 0.95 PLA2G2A (0.43) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL23266784 0.95 PLA2G2A (0.43) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL26949481 0.95 CA12 (0.39) KDM4EALDH1A1MAPTHPGDMEN1

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
WO-2023239193-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2023-12-14 WO disclosed