SCHEMBL24314933

SCHEMBL24314933

C1=Cc2c(oc3ccccc23)C(c2nc(-c3ccccc3)nc(-c3cccc4oc5cccc(-c6ccccc6)c5c34)n2)C1

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.31
▸ KDM4E B2RXH2 4/20 0.31
▸ TSHR P16473 3/20 0.31
▸ LMNA P02545 2/20 0.31
▸ MAPK1 P28482 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ ALDH1A1 P00352 3/20 0.30
▸ POLB P06746 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ NFKB1 P19838 1/20 0.30
▸ NFKB2 Q00653 1/20 0.30
▸ RELA Q04206 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL24973799 0.89 ALDH1A1 (0.34) MAPTALDH1A1
SCHEMBL24972728 0.81 BACE1 (0.30) TSHR
SCHEMBL26894486 0.78 — —
SCHEMBL24972411 0.78 ADORA3 (0.31) TSHR
SCHEMBL23822045 0.77 MAPT (0.41) MAPTKDM4ETSHRLMNAMAPK1
SCHEMBL26895422 0.76 ALOX5 (0.33) MAPTKDM4ETSHRLMNAMAPK1
SCHEMBL26893790 0.76 KDM4E (0.32) KDM4EHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL22884276 0.76 TSHR (0.44) MAPTKDM4ETSHRLMNAMAPK1
SCHEMBL23821196 0.76 TSHR (0.44) MAPTKDM4ETSHRLMNAMAPK1
SCHEMBL25653235 0.75 TSHR (0.33) MAPTKDM4ETSHRLMNAMAPK1

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-3972001-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2022-03-23 — — EP disclosed
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