SCHEMBL9968084

SCHEMBL9968084

Cn1c2cc(C(C)(C)C)ncc2c2cnc(C(C)(C)C)cc21

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
GRN P28799 1/20 0.32
SORT1 Q99523 1/20 0.32
MAP3K5 Q99683 1/20 0.30
KIF11 P52732 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
SCHEMBL9968112 0.87 TOP2A (0.40)
SCHEMBL22357758 0.76 ADORA2A (0.53) KDM4EGRNSORT1
SCHEMBL21024075 0.75 HSD17B10 (0.43) KDM4E
SCHEMBL9968120 0.75 TOP2A (0.40)
SCHEMBL10183192 0.74 CLK4 (0.34) KDM4E
SCHEMBL9968128 0.73 HTR1D (0.39) KDM4EKIF11
SCHEMBL10183193 0.72 KDM4E (0.46) KDM4E
SCHEMBL14866990 0.72 ACSS2 (0.33)
SCHEMBL21419218 0.71 TRPM5 (0.35) KDM4EGRNSORT1
SCHEMBL10183099 0.71 DYRK1A (0.38) KDM4E

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-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed
US-20120153817-A1 ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-06-21 US disclosed