SCHEMBL25672018

SCHEMBL25672018

N#Cc1cc(-c2cccc(-c3ccccc3)c2)cc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4-c4ccccc4)ccc32)c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.34
METAP2 P50579 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSPO P30536 1/20 0.33
PRKDC P78527 1/20 0.32
ALDH1A3 P47895 1/20 0.32
PDK2 Q15119 1/20 0.31
CYP19A1 P11511 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PTGER4 P35408 1/20 0.31
SGK1 O00141 1/20 0.31
MAP4K4 O95819 1/20 0.31
PTPN5 P54829 1/20 0.31
ADORA2A P29274 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
SCHEMBL28371419 0.91 TSPO (0.36) PGRMETAP2KDM4EATML3MBTL1
SCHEMBL22379425 0.91 ADRA2C (0.36) PGRMETAP2KDM4EATML3MBTL1
SCHEMBL22378793 0.91 KDM4E (0.37) PGRMETAP2KDM4EATML3MBTL1
SCHEMBL26614358 0.90 ADRA2C (0.35) PGRKDM4EATML3MBTL1PRKDC
SCHEMBL26614072 0.90 ADRA2C (0.35) PGRKDM4EATML3MBTL1PRKDC
SCHEMBL22378513 0.90 ADRA2C (0.35) PGRKDM4EATML3MBTL1PRKDC
SCHEMBL22379470 0.90 ADRA2C (0.35) PGRKDM4EATML3MBTL1PRKDC
SCHEMBL22378333 0.90 PTGER4 (0.34) PGRMETAP2KDM4EATML3MBTL1
SCHEMBL22378483 0.90 PTGER4 (0.34) PGRMETAP2KDM4EATML3MBTL1
SCHEMBL21022644 0.90 KDM4E (0.41) PGRMETAP2KDM4EATML3MBTL1

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-20230200233-A1 COMPOSITION, ELECTRONIC COMPOMENT AND ELECTRONIC DEVICE CONTAINING THE COMPOSITION SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 US disclosed
US-20230200233-A1 COMPOSITION, ELECTRONIC COMPOMENT AND ELECTRONIC DEVICE CONTAINING THE COMPOSITION SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 US disclosed