SCHEMBL24034565

SCHEMBL24034565

CC(C)(O)C(C)(C)OBc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5ccccc5c34)n2)c2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.32
LMNA P02545 3/20 0.32
HTT P42858 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
ADRB2 P07550 1/20 0.31
TERT O14746 2/20 0.31
ABCG2 Q9UNQ0 1/20 0.31
CDC14B O60729 1/20 0.31
CDC14A Q9UNH5 1/20 0.31
ALDH1A1 P00352 2/20 0.31
USP2 O75604 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL24028844 0.92 MAPT (0.33) MAPTLMNAHTTKMT2APOLB
SCHEMBL24030557 0.89 TERT (0.31) MAPTLMNAHTTKMT2APOLB
SCHEMBL24030726 0.88 MAPT (0.33) MAPTLMNAHTTKMT2APOLB
SCHEMBL24029293 0.87 ABCG2 (0.37) MAPTLMNAKMT2ATSHRABCG2
SCHEMBL24028931 0.86 ABCG2 (0.37) MAPTLMNAHTTKMT2APOLB
SCHEMBL21650695 0.85 ADRB2 (0.37) ADRB2CDC14BCDC14AALDH1A1
SCHEMBL24034599 0.81 CYP2C9 (0.34) KMT2ATSHRABCG2ALDH1A1USP2
SCHEMBL24028992 0.80 ABCG2 (0.31) ABCG2
SCHEMBL20391904 0.78 PLA2G2A (0.34) MAPTLMNAHTTKMT2APOLB
SCHEMBL27334209 0.78 ADRB2 (0.37) KMT2AADRB2CDC14BCDC14AMEN1

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-2021230655-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-11-18 WO disclosed