SCHEMBL23463263

SCHEMBL23463263

Cc1cc(C)cc(-n2c3c(c4cc(C(C)(C)C)ccc42)C(C)(C)c2ccccc2-3)c1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 3/20 0.33
PGR P06401 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.31
NPC1 O15118 1/20 0.31
PLA2G1B P04054 1/20 0.31
NFKB1 P19838 1/20 0.31
CASP3 P42574 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31
RORA P35398 1/20 0.31
RORC P51449 1/20 0.31
RORB Q92753 1/20 0.31

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
SCHEMBL24430989 0.93 PGR (0.35) DNMT1PGRALDH1A1MAPTNPC1
SCHEMBL24431073 0.88 PGR (0.38) DNMT1PGRALDH1A1NPC1PLA2G1B
SCHEMBL24431089 0.86 PGR (0.37) DNMT1PGRALDH1A1NPC1PLA2G1B
SCHEMBL22951906 0.84 PGR (0.35) PGRALDH1A1MAPTL3MBTL1
SCHEMBL24431075 0.84 PGR (0.35) DNMT1PGRALDH1A1NPC1PLA2G1B
SCHEMBL22952026 0.82 PGR (0.34) DNMT1PGRALDH1A1MAPT
SCHEMBL19978120 0.81 PGR (0.37) DNMT1PGRALDH1A1MAPTNPC1
SCHEMBL24431025 0.77 PGR (0.40) PGRALDH1A1RORC
SCHEMBL24431091 0.77 MAPT (0.35) PGRMAPT
SCHEMBL24431171 0.76 PGR (0.38) PGR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3909958-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG Chem, Ltd. (KR) 2021-11-17 EP disclosed
WO-2021107678-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-06-03 WO disclosed