SCHEMBL24028992

SCHEMBL24028992

CC(C)(O)C(C)(C)OBc1cccc2c(-c3nc(-c4ccccc4)nc(-c4cccc5sc6ccccc6c45)n3)cccc12

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 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
SCHEMBL24028931 0.89 ABCG2 (0.37) ABCG2
SCHEMBL22700613 0.86 ALOX15 (0.31) ABCG2
SCHEMBL24029293 0.83 ABCG2 (0.37) ABCG2
SCHEMBL24034599 0.81 CYP2C9 (0.34) ABCG2
SCHEMBL24034565 0.80 MAPT (0.32) ABCG2
SCHEMBL21563732 0.79 TSHR (0.39) ABCG2
SCHEMBL22249828 0.79 GPR3 (0.35)
SCHEMBL27452034 0.78 F9 (0.34)
SCHEMBL24028844 0.78 MAPT (0.33) ABCG2
SCHEMBL24266825 0.78 GPR3 (0.41) ABCG2

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-2021230654-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-11-18 WO disclosed