SCHEMBL21755595

SCHEMBL21755595

c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-n4c5ccccc5c5c(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccc(-n9c%10ccccc%10c%10ccc%11c%12ccccc%12oc%11c%109)cc8)n7)cc6)cc6c7ccccc7oc6c54)cc3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.32
TSHR P16473 3/20 0.32
KDM4E B2RXH2 2/20 0.32
HSD17B10 Q99714 2/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 3/20 0.32
POLB P06746 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALOX5 P09917 1/20 0.30
HPGD P15428 1/20 0.30
MEN1 O00255 1/20 0.30
BRCA1 P38398 1/20 0.30
KMT2A Q03164 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
SCHEMBL25654670 0.93 ALOX5 (0.31) ALOX5
SCHEMBL21755596 0.93 MAPT (0.33) MAPTTSHRKDM4EHSD17B10LMNA
SCHEMBL25654677 0.92 MAPT (0.31) MAPTTSHRKDM4EHSD17B10LMNA
SCHEMBL26048725 0.90 MAPT (0.32) MAPTTSHRKDM4EHSD17B10LMNA
SCHEMBL19863046 0.90 KDM4E (0.34) MAPTTSHRKDM4EHSD17B10LMNA
SCHEMBL19862903 0.90 MAPT (0.34) MAPTTSHRKDM4EHSD17B10LMNA
SCHEMBL18594227 0.89 KDM4E (0.35) MAPTTSHRKDM4EHSD17B10LMNA
SCHEMBL18594077 0.89 MAPT (0.34) MAPTTSHRKDM4EHSD17B10LMNA
SCHEMBL18594080 0.88 SIRT2 (0.33) MAPTTSHRKDM4EHSD17B10LMNA
SCHEMBL19474358 0.88 MAPT (0.36) MAPTTSHRKDM4EHSD17B10LMNA

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
US-10573839-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-25 US disclosed