SCHEMBL10330895

SCHEMBL10330895

CC(C)(c1cc(-c2ccccc2)cc(-c2ccc(F)nc2F)n1)c1cc(-c2ccccc2)cc(-c2ccc(F)nc2F)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
POLB P06746 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP19A1 P11511 1/20 0.33
GABRA1 P14867 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
TOP1 P11387 1/20 0.32
HSD17B10 Q99714 3/20 0.31
ADORA1 P30542 3/20 0.31
ADORA3 P0DMS8 2/20 0.31
ACP1 P24666 1/20 0.31
ADORA2B P29275 1/20 0.31
LTB4R Q15722 3/20 0.31
GRM5 P41594 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TSHR P16473 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
SCHEMBL9007693 0.81
SCHEMBL9007724 0.80 GRM5 (0.34) MEN1KMT2AACP1GRM5TSHR
SCHEMBL9007709 0.78 ALOX5AP (0.32)
SCHEMBL9007610 0.76 IDH1 (0.36)
SCHEMBL9007694 0.76 CYP1A1 (0.32) MEN1KMT2AKDM4ERAB9ACYP1A2
SCHEMBL9007699 0.76 SNCA (0.31)
SCHEMBL9007736 0.72 AR (0.33)
SCHEMBL9007745 0.70 IDH1 (0.32)
SCHEMBL17829249 0.69 MEN1 (0.53) POLBMEN1KMT2ACYP19A1HSD17B10
SCHEMBL13260546 0.69 KDM4E (0.39) LMNAKDM4ETSHRHPGD

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
US-8426042-B2 Material for organic electroluminescence device, and organic electroluminescence device UDC IRELAND LIMITED (IE) 2013-04-23 US disclosed
US-8426042-B2 Material for organic electroluminescence device, and organic electroluminescence device UDC IRELAND LIMITED (IE) 2013-04-23 US disclosed
US-20120181528-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-07-19 US disclosed
US-20120181528-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE FUJIFILM CORPORATION (JP) 2012-07-19 US disclosed