SCHEMBL28083706

SCHEMBL28083706

Clc1c(-c2ccccc2)ccnc1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 5/20 0.44
CDK2 P24941 5/20 0.44
CDK5 Q00535 2/20 0.42
CDK7 P50613 2/20 0.42
IKBKB O14920 1/20 0.42
CHUK O15111 1/20 0.42
DAPK3 O43293 1/20 0.42
JAK2 O60674 1/20 0.42
PRKD3 O94806 1/20 0.42
MAP4K4 O95819 1/20 0.42
PAK4 O96013 1/20 0.42
CSF1R P07333 1/20 0.42
RET P07949 1/20 0.42
IGF1R P08069 1/20 0.42
FGFR1 P11362 1/20 0.42
PRKACA P17612 1/20 0.42
FLT1 P17948 1/20 0.42
LTK P29376 1/20 0.42
GRK5 P34947 1/20 0.42
KDR P35968 1/20 0.42

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
SCHEMBL7861011 0.81 LRRK2 (0.43) CCNA2CDK2CDK5CDK7IKBKB
SCHEMBL27653332 0.81 KDM4E (0.42) CDK5CYP2A6KDM4ELMNAALDH1A1
SCHEMBL3301267 0.78 BACE1 (0.41) CCNA2CDK2CDK5CDK7IKBKB
SCHEMBL28001913 0.78 BCHE (0.40) CDK5CYP2A6KDM4ELMNAALDH1A1
SCHEMBL996432 0.77 CCNA2 (0.45) CCNA2CDK2CDK5CDK7IKBKB
SCHEMBL28047039 0.76 CCNA2 (0.52) CCNA2CDK2MAP4K4KDM4ELMNA
SCHEMBL8444233 0.75 CCNA2 (0.44) CCNA2CDK2CDK5CDK7IKBKB
SCHEMBL4618932 0.75 CCNA2 (0.44) CCNA2CDK2CDK5CDK7IKBKB
SCHEMBL321472 0.75 CCNA2 (0.44) CCNA2CDK2CDK5CDK7IKBKB
SCHEMBL11606622 0.75 CHEK1 (0.46) CCNA2CDK2CDK5CDK7IKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105176523-B New organic electroluminescent compounds and the organic electroluminescent device using the compound 罗门哈斯电子材料韩国有限公司 2017-10-10 CN disclosed
CN-103641830-B Novel organic electroluminescent compounds and organic electroluminescent device using the same 罗门哈斯电子材料韩国有限公司 2017-04-12 CN disclosed
CN-103555322-B New organic electroluminescent compounds and the organic electroluminescent device of this compound of use 罗门哈斯电子材料韩国有限公司 2016-08-17 CN disclosed