SCHEMBL28048700

SCHEMBL28048700

NC(=O)c1ccc2[nH]c3c(-c4ccc(N)cc4)cc(C(N)=O)cc3c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 1/20 0.42
JAK2 O60674 9/20 0.42
HTR1B P28222 2/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
HTR1A P08908 1/20 0.40
TSHR P16473 1/20 0.40
HTR1D P28221 1/20 0.40
HTR2C P28335 1/20 0.40
HTR7 P34969 1/20 0.40
HTR5A P47898 1/20 0.40
HTR6 P50406 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAP2K7 O14733 1/20 0.40
BTK Q06187 5/20 0.39
JAK1 P23458 4/20 0.39
TYK2 P29597 4/20 0.39
JAK3 P52333 4/20 0.39
TLR8 Q9NR97 1/20 0.38

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
SCHEMBL28048821 0.84 TSHR (0.49) CHEK2JAK2MEN1TSHRKMT2A
SCHEMBL27852041 0.74 KIF11 (0.51) HTR1BMEN1CYP1A2HTR1ATSHR
SCHEMBL8226965 0.73 MAPK14 (0.53) CHEK2ARPARP10
Terephthalamide SCHEMBL28385024 0.73 PARP1 (0.50) HTR1BMEN1CYP1A2HTR1ATSHR
SCHEMBL3786947 0.73 PARP10 (0.47) CHEK2ARPARP10
SCHEMBL5394297 0.71 POLB (0.50) JAK2HTR1BMEN1CYP1A2HTR1A
SCHEMBL14972617 0.71 PARP10 (0.46) CHEK2ARPARP10
SCHEMBL11810570 0.70 KIF11 (0.57) HTR1BMEN1CYP1A2HTR1ATSHR
SCHEMBL3790168 0.70 PARP10 (0.47) CHEK2HSD17B10PARP10
SCHEMBL28221114 0.69 CDK4 (0.43) JAK2MEN1TSHRKMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105237462-B It is a kind of that there is high flatness diamine monomer and its synthetic method and application containing carbazole structure 湖南工业大学 2018-11-27 CN disclosed
CN-105482116-B A kind of polyimide nano-composite material and its preparation method and application containing carbazole structure 湖南工业大学 2018-08-07 CN disclosed
CN-105482116-A Polyimide nanometer composite with carbazole structure and preparation method and application of polyimide nanometer composite UNIV HUNAN TECH 2016-04-13 CN disclosed
CN-105461925-A Polyimide containing carbazole structure, preparation method thereof and application thereof UNIV HUNAN TECH 2016-04-06 CN disclosed
CN-105237462-A Diamine monomer containing carbazole structure and having high planarity, synthetic method and application thereof UNIV HUNAN TECHNOLOGY 2016-01-13 CN disclosed