SCHEMBL530136

SCHEMBL530136

NC(=O)/C=C/c1ccccc1-c1ccccc1Nc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.44
SIRT2 Q8IXJ6 4/20 0.43
PTPN1 P18031 2/20 0.42
SIRT1 Q96EB6 2/20 0.41
BACE1 P56817 2/20 0.41
FABP4 P15090 1/20 0.41
MAPT P10636 5/20 0.40
KDM4E B2RXH2 2/20 0.40
PKM P14618 1/20 0.40
NPC1 O15118 1/20 0.39
MAOB P27338 1/20 0.39
RAB9A P51151 1/20 0.39
GAA P10253 2/20 0.39
GFER P55789 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
NFKB1 P19838 1/20 0.39
CA4 P22748 1/20 0.39
ALOX15 P16050 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL530312 0.88 SIRT2 (0.48) SIRT2PTPN1SIRT1FABP4MAPT
SCHEMBL530138 0.80 SIRT2 (0.51) BRD4SIRT2SIRT1BACE1FABP4
SCHEMBL28399567 0.76 BACE1 (0.49) PTPN1BACE1CA1CA2NFKB1
SCHEMBL3667411 0.76 BACE1 (0.55) PTPN1BACE1CA1CA2NFKB1
SCHEMBL27642891 0.76 BACE1 (0.55) PTPN1BACE1CA1CA2NFKB1
SCHEMBL11829602 0.74 CA1 (0.55) SIRT2SIRT1FABP4MAPTKDM4E
SCHEMBL11829593 0.74 CA1 (0.55) SIRT2SIRT1FABP4MAPTKDM4E
SCHEMBL28027906 0.73 BRD4 (0.59) BRD4SIRT2SIRT1FABP4MAPT
SCHEMBL16586699 0.73 PTGER1 (0.48) PTPN1MAPTKDM4ENPC1MAOB
SCHEMBL2328371 0.73 NFKB1 (0.50) PTPN1MAPTKDM4ECA1CA2

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
EP-2598825-A2 BALLISTIC SHIELD COMPOSITES WITH ENHANCED FRAGMENT RESISTANCE Honeywell International, Inc. (US) 2013-06-05 EP disclosed
WO-2012015680-A2 BALLISTIC SHIELD COMPOSITES WITH ENHANCED FRAGMENT RESISTANCE HONEYWELL INTERNATIONAL INC. (US) 2012-02-02 WO disclosed