SCHEMBL29444843

SCHEMBL29444843

c1ccc(-c2nccn2-c2ccc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccccc34)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 2/20 0.60
MAPK10 P53779 2/20 0.60
P2RX4 Q99571 1/20 0.47
KDR P35968 14/20 0.41
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
FLT1 P17948 5/20 0.38
FLT4 P35916 5/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL18999437 0.96 MAPK9 (0.58) MAPK9MAPK10P2RX4KDRESR1
SCHEMBL18999436 0.86 MAPK9 (0.46) MAPK9MAPK10P2RX4KDRESR1
SCHEMBL15315972 0.83 MAPK10 (0.83) MAPK9MAPK10P2RX4KDRFLT1
SCHEMBL19961727 0.83 MAPK9 (0.64) MAPK9MAPK10P2RX4KDRFLT1
SCHEMBL5914875 0.80 HTR2C (0.44) MAPK9MAPK10
SCHEMBL5502280 0.77 ESR1 (0.53) ESR1ESR2
SCHEMBL30730877 0.77 ESR1 (0.53) ESR1ESR2
SCHEMBL18999346 0.76 MAPK9 (0.48) MAPK9MAPK10P2RX4KDRESR1
SCHEMBL27721362 0.75 MAPK9 (0.47) MAPK9MAPK10P2RX4KDRFLT1
SCHEMBL15366682 0.75 HSD17B1 (0.52) ESR1ESR2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110291652-B Organic electroluminescent element, display device, lighting device, and compound 学校法人关西学院 2022-05-17 CN disclosed
CN-114437121-A Polycyclic aromatic compound, reactive compound, material for organic device, ink composition, and organic electroluminescent element 学校法人关西学院 2022-05-06 CN disclosed
CN-114149456-A Polycyclic aromatic compound and application thereof 学校法人关西学院 2022-03-08 CN disclosed
CN-114026147-A Polycyclic aromatic compound 学校法人关西学院 2022-02-08 CN disclosed