SCHEMBL15977906

SCHEMBL15977906

Cc1ccc2c(-c3ccc4ccccc4c3)c3cc(-c4ccncc4)ccc3c(-c3ccc4ccccc4c3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.45
MAPK9 P45984 6/20 0.44
MAPK10 P53779 6/20 0.44
MAPK8 P45983 3/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CYP2A6 P11509 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CYP17A1 P05093 1/20 0.42
CYP19A1 P11511 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
CHEK1 O14757 1/20 0.42
CYP2C9 P11712 2/20 0.41

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
SCHEMBL15077952 0.91 MAPK9 (0.51) MAPK14MAPK9MAPK10MAPK8CYP17A1
SCHEMBL15077951 0.90 MAPK9 (0.50) MAPK14MAPK9MAPK10MAPK8CYP17A1
SCHEMBL15977682 0.90 MAPK9 (0.50) MAPK14MAPK9MAPK10MAPK8CYP17A1
SCHEMBL15977856 0.87 MAPK9 (0.50) MAPK14MAPK9MAPK10MAPK8CYP17A1
SCHEMBL10030056 0.87 MAPK9 (0.50) MAPK14MAPK9MAPK10MAPK8CYP17A1
SCHEMBL1103615 0.86 CYP17A1 (0.45) MAPK14MAPK9MAPK10MAPK8ALDH1A1
SCHEMBL15977838 0.86 CYP17A1 (0.47) MAPK9MAPK10MAPK8ALDH1A1KDM4E
SCHEMBL10030064 0.86 CYP17A1 (0.47) MAPK14MAPK9MAPK10MAPK8CYP17A1
SCHEMBL10032635 0.85 IMPDH2 (0.43) MAPK14MAPK9MAPK10MAPK8ALDH1A1
SCHEMBL12571762 0.85 MAPK9 (0.51) MAPK14MAPK9MAPK10MAPK8CYP17A1

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-9559311-B2 Anthracene derivative, organic-electroluminescence-device material, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2017-01-31 US disclosed
US-20140239273-A1 ANTHRACENE DERIVATIVE, ORGANIC-ELECTROLUMINESCENCE-DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-08-28 US disclosed