SCHEMBL3675429

SCHEMBL3675429

COc1ccccc1-c1c(O)ccc(C(N)=O)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.47
PIM1 P11309 1/20 0.47
PARP1 P09874 1/20 0.45
ALDH1A1 P00352 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
KDM4E B2RXH2 2/20 0.44
HSD17B10 Q99714 2/20 0.44
IKBKB O14920 2/20 0.43
MAP2 P11137 2/20 0.43
CDC7 O00311 1/20 0.43
HPGD P15428 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 3/20 0.40
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MITF O75030 1/20 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
SCHEMBL3676042 0.87 EGFR (0.47) EGFRPIM1PARP1ALDH1A1KMT2A
SCHEMBL3678173 0.82 ALDH1A1 (0.47) PARP1ALDH1A1KMT2AMEN1KDM4E
SCHEMBL3686051 0.81 HPGD (0.52) ALDH1A1KMT2AMEN1KDM4EHSD17B10
SCHEMBL3685207 0.80 MYC (0.51) ALDH1A1KMT2AMEN1KDM4EHSD17B10
SCHEMBL2464591 0.79 IKBKB (0.48) PARP1ALDH1A1KDM4EHSD17B10IKBKB
SCHEMBL3671297 0.77 MAPT (0.41) EGFRALDH1A1KMT2AMEN1KDM4E
SCHEMBL527995 0.76 PARP1 (0.56) PARP1ALDH1A1KDM4EHSD17B10IKBKB
SCHEMBL18317888 0.76 KEAP1 (0.47) ALDH1A1KMT2AMEN1KDM4EHSD17B10
SCHEMBL4117320 0.76 MYC (0.54) PARP1ALDH1A1KMT2AIKBKBMAP2
SCHEMBL5582517 0.75 PARP1 (0.52) PARP1ALDH1A1KDM4EHSD17B10IKBKB

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-2182914-A2 COMPOSITION OXIDATION COLOURING OF KERATINIC FIBRES, CONTAINING A CATIONIC CELLULOSE ETHER, A METASILICATE AND OXIDATION DYES, METHOD FOR OXIDATION COLOURING AND USES THEREOF L'Oreal (FR) 2010-05-12 EP disclosed
EP-2175830-A2 COMPOSITION FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC CELLULOSE ETHER, A WEAKLY OXYETHYLENATED SORBITAN FATTY ACID ESTER AND OXIDATION DYES L'Oreal (FR) 2010-04-21 EP disclosed
WO-2009019383-A2 COMPOSITION OXIDATION COLOURING OF KERATINIC FIBRES, CONTAINING A CATIONIC CELLULOSE ETHER, A METASILICATE AND OXIDATION DYES, METHOD FOR OXIDATION COLOURING AND USES THEREOF L'OREAL (FR) 2009-02-12 WO disclosed
WO-2009016061-A2 COMPOSITION FOR OXIDATION DYEING KERATIN FIBRES COMPRISING A CATIONIC CELLULOSE ETHER, A WEAKLY OXYETHYLENATED SORBITAN FATTY ACID ESTER AND OXIDATION DYES L'OREAL (FR) 2009-02-05 WO disclosed