SCHEMBL9920771

SCHEMBL9920771

Cc1cc2ccc3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccc(c1)c2c34

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ATM Q13315 1/20 0.40
CYP1A2 P05177 2/20 0.36
ERBB2 P04626 1/20 0.36
FYN P06241 1/20 0.36
MAOA P21397 1/20 0.36
ACHE P22303 1/20 0.36
AHR P35869 1/20 0.36
AKR1C4 P17516 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
ALDH1A1 P00352 4/20 0.33
RXFP1 Q9HBX9 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HDAC4 P56524 1/20 0.33
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL9920675 0.92 KDM4E (0.40) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL21234885 0.91 KDM4E (0.41) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL9921080 0.91 L3MBTL1 (0.43) L3MBTL1KDM4EATMAKR1C4AKR1C3
SCHEMBL9920625 0.91 L3MBTL1 (0.43) L3MBTL1KDM4EATMAKR1C4AKR1C3
SCHEMBL9921053 0.89 L3MBTL1 (0.50) L3MBTL1KDM4EATMCYP1A2ERBB2
SCHEMBL13872153 0.89 KDM4E (0.37) L3MBTL1KDM4EATMCYP1A2AKR1C4
SCHEMBL9920956 0.88 L3MBTL1 (0.42) L3MBTL1KDM4EATMAKR1C4AKR1C3
SCHEMBL13872311 0.88 KDM4E (0.39) L3MBTL1KDM4EATMAKR1C4AKR1C3
SCHEMBL9920725 0.88 KDM4E (0.39) L3MBTL1KDM4EATMAKR1C4AKR1C3
SCHEMBL9920635 0.88 L3MBTL1 (0.39) L3MBTL1KDM4EATMAKR1C4AKR1C3

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
EP-2463351-A2 Light emitting device material and light emitting device Toray Industries, Inc. (JP) 2012-06-13 EP disclosed
EP-2463352-A2 Light emitting device material and light emitting device Toray Industries, Inc. (JP) 2012-06-13 EP disclosed