SCHEMBL28060253

SCHEMBL28060253

c1ccc(Cc2cccc(Nc3ccccc3N(c3ccccc3)c3ccccc3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 2/20 0.39
RAPGEF4 Q8WZA2 1/20 0.37
TOP2A P11388 1/20 0.37
TOP2B Q02880 1/20 0.37
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CTSV O60911 1/20 0.36
CTSL P07711 1/20 0.36
CALM1 P0DP23 1/20 0.35
SIRT2 Q8IXJ6 5/20 0.35
ALDH1A1 P00352 1/20 0.35
AR P10275 1/20 0.35
CYP3A4 P08684 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL27566842 0.87 HTR6 (0.43) SIRT1RAPGEF4TOP2ATOP2BCTSV
SCHEMBL27955144 0.86 RAPGEF4 (0.37) SIRT1RAPGEF4TOP2ATOP2BMEN1
SCHEMBL3175953 0.81 MAPT (0.48) MEN1MAPTKMT2AKDM4EGLA
SCHEMBL30296910 0.81 MAPT (0.48) MEN1MAPTKMT2AKDM4EGLA
SCHEMBL27679218 0.80 CFD (0.48) SIRT1SIRT2
SCHEMBL1742394 0.79 NPSR1 (0.56) MEN1MAPTKMT2ARECQLCYP3A4
SCHEMBL18150356 0.78 MAPT (0.48) RAPGEF4TOP2ATOP2BMEN1MAPT
SCHEMBL28714790 0.75 KDM1A (0.42) MEN1MAPTKMT2AKDM4EGLA
SCHEMBL5839725 0.75 NPSR1 (0.50) MEN1MAPTKMT2AKDM4EGLA
SCHEMBL27926361 0.74 BPTF (0.40) SIRT1RAPGEF4TOP2ATOP2BKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103715367-B Organic light emitting diode and electronic equipment HEFEI BOE OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2016-03-30 CN disclosed