SCHEMBL22329705

SCHEMBL22329705

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6nc(-c7ccccc7)nc(-n7c8ccccc8c8c(-c9ccccc9)cccc87)n6)cccc5c34)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.38
NPSR1 Q6W5P4 3/20 0.36
ALDH1A1 P00352 7/20 0.35
TSHR P16473 6/20 0.35
KDM4E B2RXH2 4/20 0.35
POLB P06746 2/20 0.35
HSD17B10 Q99714 4/20 0.35
LMNA P02545 4/20 0.35
MAPK1 P28482 3/20 0.35
USP2 O75604 1/20 0.34
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
PRKDC P78527 1/20 0.33
KMT2A Q03164 6/20 0.33
MEN1 O00255 5/20 0.33
HPGD P15428 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33

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
SCHEMBL24216235 0.99 MAPT (0.37) MAPTNPSR1ALDH1A1TSHRKDM4E
SCHEMBL24216103 0.99 MAPT (0.38) MAPTNPSR1ALDH1A1TSHRKDM4E
SCHEMBL26725824 0.94 MAPT (0.38) MAPTNPSR1ALDH1A1TSHRKDM4E
SCHEMBL24216209 0.94 MAPT (0.37) MAPTNPSR1ALDH1A1TSHRKDM4E
SCHEMBL22329529 0.94 MAPT (0.37) MAPTNPSR1ALDH1A1TSHRKDM4E
SCHEMBL24216154 0.93 MAPT (0.37) MAPTNPSR1ALDH1A1TSHRKDM4E
SCHEMBL24216126 0.93 MAPT (0.35) MAPTNPSR1ALDH1A1TSHRKDM4E
SCHEMBL22329374 0.92 MAPT (0.36) MAPTNPSR1ALDH1A1TSHRKDM4E
SCHEMBL24216097 0.92 MAPT (0.36) MAPTNPSR1ALDH1A1TSHRKDM4E
SCHEMBL26051310 0.92 MAPT (0.36) MAPTNPSR1ALDH1A1TSHRKDM4E

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-11581494-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-02-14 US disclosed
US-20200259098-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2020-08-13 US disclosed