SCHEMBL8534634

SCHEMBL8534634

CC(=O)/C=C/c1ccccc1N(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
LMNA P02545 3/20 0.59
KDM4E B2RXH2 2/20 0.54
IAPP P10997 1/20 0.51
TDP1 Q9NUW8 2/20 0.50
GLA P06280 1/20 0.50
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
TP53 P04637 2/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.46
PTPN1 P18031 4/20 0.43
KMT2A Q03164 2/20 0.42
ATM Q13315 1/20 0.42
NSD2 O96028 1/20 0.41
EGFR P00533 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
NFE2L2 Q16236 2/20 0.40
NFKB1 P19838 2/20 0.40

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
SCHEMBL8534636 1.00 MAPT (0.59) MAPTLMNAKDM4EIAPPTDP1
SCHEMBL6561859 0.85 CA1 (0.56) MAPTLMNAKDM4EALDH1A1SMN1; SMN2
SCHEMBL7455794 0.85 CA1 (0.56) MAPTLMNAKDM4EALDH1A1SMN1; SMN2
SCHEMBL7677074 0.84 PTPN1 (0.56) MAPTLMNAKDM4ETDP1ALDH1A1
SCHEMBL20030390 0.82 MAPT (0.40) MAPTLMNAKDM4EIAPPTDP1
SCHEMBL14441077 0.82 MAPT (0.76) MAPTLMNAKDM4EIAPPTDP1
SCHEMBL815585 0.81 MAPT (0.58) MAPTLMNAKDM4EALDH1A1SMN1; SMN2
SCHEMBL12425723 0.81 HDAC8 (0.58) MAPTALDH1A1SMN1; SMN2TP53KMT2A
SCHEMBL815583 0.81 MAPT (0.58) MAPTLMNAKDM4EALDH1A1SMN1; SMN2
SCHEMBL29523356 0.80 GSK3B (0.44) MAPTLMNAKDM4ETDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0873743-A2 Use of benzylidene-ketones for dyeing keratinous fibers Henkel Kommanditgesellschaft auf Aktien (DE) 1998-10-28 EP claimed
EP-2928471-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2015-10-14 EP disclosed
WO-2014089364-A1 HISTONE DEMETHYLASE INHIBITORS QUANTICEL PHARMACEUTICALS, INC (US) 2014-06-12 WO disclosed
EP-0873743-A2 Use of benzylidene-ketones for dyeing keratinous fibers Henkel Kommanditgesellschaft auf Aktien (DE) 1998-10-28 EP disclosed