SCHEMBL25824818

SCHEMBL25824818

CC(C)(C)c1cc(C(C)(C)C)c(-n2c3ccc(C(C)(C)C)cc3c(=O)c3cc4c(cc32)c(=O)c2ccc(C(C)(C)C)cc2n4-c2c(C(C)(C)C)cc(C(C)(C)C)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.35
RORA P35398 1/20 0.35
RORC P51449 1/20 0.35
RORB Q92753 1/20 0.35
DNMT1 P26358 3/20 0.33
HTR1D P28221 1/20 0.33
NR1I2 O75469 1/20 0.33
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PLA2G1B P04054 1/20 0.30
NFKB1 P19838 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
ATG4B Q9Y4P1 1/20 0.30

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
SCHEMBL25824814 0.86 MARK4 (0.36) PGRRORARORCRORBNPC1
SCHEMBL25752485 0.86 PPARG (0.33) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL24702437 0.86 ALDH1A1 (0.39) PGRRORARORCRORBNPC1
SCHEMBL25752483 0.84 MARK4 (0.33)
SCHEMBL25752570 0.83 NR1I2 (0.34) NR1I2
SCHEMBL25752486 0.82 GABBR2 (0.31)
SCHEMBL25752490 0.81 PGR (0.32) PGRRORARORCRORB
SCHEMBL25752489 0.81 PPARG (0.33) RORARORCRORB
SCHEMBL22960147 0.80 CA9 (0.34) PGRRORARORCRORBDNMT1
SCHEMBL25752484 0.80 POLB (0.32)

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
US-20230209988-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE HAVING THE SAME LG DISPLAY CO., LTD. (KR) 2023-06-29 US disclosed
US-20230209988-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE HAVING THE SAME LG DISPLAY CO., LTD. (KR) 2023-06-29 US disclosed