SCHEMBL24570973

SCHEMBL24570973

CC(C)(C)c1ccc2c(c1)c(=O)c1cc(I)cc3c(=O)c4c(ccc5c(=O)c6cc(C(C)(C)C)cc7c(=O)c8cc(C(C)(C)C)ccc8n(c76)c54)n2c13

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.32
RORA P35398 1/20 0.32
RORC P51449 1/20 0.32
RORB Q92753 1/20 0.32
HTR1D P28221 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
SCHEMBL24570766 0.94 HTR1D (0.35) PGRRORARORCRORBHTR1D
SCHEMBL25758053 0.85 HTR1D (0.34) PGRRORARORCRORBHTR1D
SCHEMBL24570754 0.84 ATM (0.36) PGRRORARORCRORB
SCHEMBL25758043 0.83 HTR1D (0.38) PGRRORARORCRORBHTR1D
SCHEMBL25758070 0.81 PGR (0.37) PGRRORARORCRORBHTR1D
SCHEMBL24571083 0.80 ABCB1 (0.36) PGRRORARORCRORB
SCHEMBL24570893 0.80 ATM (0.35)
SCHEMBL24494743 0.79 HTR1D (0.38) PGRRORARORCRORBHTR1D
SCHEMBL24276377 0.78 HTR1D (0.38) PGRRORARORCRORBHTR1D
SCHEMBL25758015 0.78 HTR1D (0.38) PGRRORARORCRORBHTR1D

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-4019520-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2022-06-29 EP disclosed