SCHEMBL3674472

SCHEMBL3674472

CC=C(CC)c1cccc(CN=C=O)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.37
PTGS2 P35354 2/20 0.37
VDR P11473 1/20 0.35
CYP4F2 P78329 2/20 0.34
CYP4A11 Q02928 2/20 0.34
MIF P14174 2/20 0.33
MEP1B Q16820 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
NOS1 P29475 1/20 0.32
FOLH1 Q04609 1/20 0.32
BCHE P06276 1/20 0.32
CNR2 P34972 1/20 0.32
TP53 P04637 1/20 0.31
PKM P14618 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL374482 0.77 MIF (0.36) CYP4F2CYP4A11MIFMEN1KMT2A
Alcohol SCHEMBL28895010 0.77 CYP4F2 (0.37) CYP4F2CYP4A11MIFMEP1BMEN1
SCHEMBL30885594 0.76 FOLH1 (0.56) MEP1BKMT2AFOLH1SMN1; SMN2MRGPRX4
SCHEMBL27661227 0.76 FOLH1 (0.56) MEP1BKMT2AFOLH1SMN1; SMN2MRGPRX4
SCHEMBL28678099 0.75 MEP1B (0.49) MEP1BMEN1KMT2AFOLH1GRIN2B
SCHEMBL31486055 0.75 ALDH1A1 (0.44) CYP4F2CYP4A11MIFMEP1BMEN1
SCHEMBL29364886 0.75 MEP1B (0.49) MEP1BMEN1KMT2AFOLH1GRIN2B
SCHEMBL5465655 0.75 MIF (0.47) MIFMEN1KMT2ANOS1NFKB1
SCHEMBL26785 0.75 MIF (0.47) MIFMEN1KMT2ANOS1NFKB1
SCHEMBL1457268 0.74 GABRA1 (0.41) MIFNOS1TP53NFKB1SMN1; SMN2

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-2173821-A2 COATING FOR DECORATIVE METALS WITH IMPROVED MAR AND SCRATCH RESISTANCE AND METHODS OF APPLICATION PPG Industries Ohio, Inc. (US) 2010-04-14 EP disclosed
WO-2009009641-A2 COATING FOR DECORATIVE METALS WITH IMPROVED MAR AND SCRATCH RESISTANCE AND METHODS OF APPLICATION PPG INDUSTRIES OHIO, INC. (US) 2009-01-15 WO disclosed