SCHEMBL2777191

SCHEMBL2777191

CCCCC1C=CCCC1=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 3/20 0.41
NFKB2 Q00653 3/20 0.41
RELA Q04206 3/20 0.41
TP53 P04637 1/20 0.33
TLR4 O00206 1/20 0.32
CYP1A2 P05177 2/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL3351382 0.89 NFKB1 (0.30) NFKB1NFKB2RELA
SCHEMBL27609553 0.81 NFKB1 (0.44) NFKB1NFKB2RELATP53TLR4
SCHEMBL11030128 0.80
SCHEMBL1614523 0.76 NFKB1 (0.39) NFKB1NFKB2RELACYP1A2ALDH1A1
SCHEMBL7516212 0.76 CYP1A2 (0.40) NFKB1NFKB2RELACYP1A2ALDH1A1
SCHEMBL27482176 0.74 CYP1A2 (0.39) NFKB1NFKB2RELACYP1A2ALDH1A1
SCHEMBL1614688 0.74 CYP1A2 (0.39) NFKB1NFKB2RELACYP1A2ALDH1A1
SCHEMBL8635869 0.73 CYP1A2 (0.37) NFKB1NFKB2RELATLR4CYP1A2
SCHEMBL27573620 0.73 MEN1 (0.33) MEN1ALDH1A1PKMKMT2A
SCHEMBL2331805 0.72

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
EP-2265564-A1 ETHYLENICALLY UNSATURATED MONOMERS COMPRISING ALIPHATIC AND AROMATIC MOIETIES Dow Global Technologies Inc. (US) 2010-12-29 EP disclosed
WO-2009114466-A1 ETHYLENICALLY UNSATURATED MONOMERS COMPRISING ALIPHATIC AND AROMATIC MOIETIES DOW GLOBAL TECHNOLOGIES INC. (US) 2009-09-17 WO disclosed
US-5563237-A INCLUDES A BISMALEIMIDE HARDENER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-08 US disclosed