SCHEMBL3213381

SCHEMBL3213381

C(=Cc1cccc(-c2ccccc2)c1-c1nc2ccccc2o1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.43
DHFR P00374 1/20 0.42
ALDH1A1 P00352 6/20 0.42
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
HSD17B10 Q99714 4/20 0.42
PTGS2 P35354 2/20 0.41
TOP2A P11388 1/20 0.41
NPC1 O15118 5/20 0.41
HPGD P15428 4/20 0.41
KDM4E B2RXH2 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 4/20 0.40
ATM Q13315 1/20 0.40
MAPT P10636 4/20 0.40
USP2 O75604 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HCRTR1 O43613 1/20 0.38
PKM P14618 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL19717967 0.92 TOP2A (0.46) TP53DHFRALDH1A1KMT2AMEN1
SCHEMBL250150 0.92 TOP2A (0.46) TP53DHFRALDH1A1KMT2AMEN1
SCHEMBL11447096 0.90 TOP2A (0.44) TP53DHFRALDH1A1KMT2AMEN1
SCHEMBL11462110 0.90 ALDH1A1 (0.42) TP53ALDH1A1KMT2AMEN1HSD17B10
SCHEMBL285168 0.84 ALDH1A1 (0.48) TP53DHFRALDH1A1KMT2AMEN1
SCHEMBL285170 0.84 ALDH1A1 (0.48) TP53DHFRALDH1A1KMT2AMEN1
SCHEMBL28887970 0.84 ALDH1A1 (0.48) TP53DHFRALDH1A1KMT2AMEN1
SCHEMBL11458764 0.81 ALDH1A1 (0.46) TP53DHFRALDH1A1KMT2AMEN1
SCHEMBL11447095 0.81 ALDH1A1 (0.46) TP53DHFRALDH1A1KMT2AMEN1
SCHEMBL7567677 0.81 PTGS2 (0.50) TP53ALDH1A1KMT2AMEN1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100234261-A1 DYE CLEANER, AND METHOD FOR CLEANING COLORANT DELIVERY SYSTEMS STINSON KELLY 2010-09-16 US disclosed
US-20060014869-A1 Dye cleaner, and method for cleaning colorant delivery systems LANXESS CORPORATION 2006-01-19 US disclosed
US-5922851-A FOR CELLULOSE FIBERS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-07-13 US disclosed
EP-0713882-B1 Phosphonomethylated chitosans CIBA GEIGY AG (CH) 1998-12-30 EP disclosed
US-5777091-A SEQUESTERING AGENTS FOR LIQUID BLEACHES CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-07-07 US disclosed
EP-0713882-A1 Phosphonomethylated chitosans CIBA-GEIGY AG (CH) 1996-05-29 EP disclosed
EP-0210132-B2 AQUEOUS, ALKALINE, SILICATE-CONTAINING COMPOSITION FOR THE BLEACHING OF CELLULOSIC FIBRES IN THE PRESENCE OF PERCOMPOUNDS CIBA-GEIGY AG (CH) 1993-04-07 EP disclosed
EP-0210132-B1 AQUEOUS, ALKALINE, SILICATE-CONTAINING COMPOSITION FOR THE BLEACHING OF CELLULOSIC FIBRES IN THE PRESENCE OF PERCOMPOUNDS CIBA-GEIGY AG (CH) 1989-12-27 EP disclosed
EP-0210952-B1 AQUEOUS, ALKALINE, SILICATE-CONTAINING COMPOSITION FOR THE BLEACHING OF CELLULOSIC FIBRES IN THE PRESENCE OF PERCOMPOUNDS CIBA-GEIGY AG (CH) 1989-08-23 EP disclosed
US-4751023-A Aqueous alkaline, silicate-containing composition for bleaching cellulosic fibre materials in the presence of per compounds CIBA-GEIGY CORPORATION (US) 1988-06-14 US disclosed
US-4725281-A Aqueous alkaline, silicate-containing composition and the use thereof for bleaching cellulosic fiber materials in the presence of per compounds CIBA-GEIGY CORPORATION (US) 1988-02-16 US disclosed
EP-0112801-B1 MAGNESIUM COMPLEXES OF OLIGOMERIC PHOSPHONIC-ACID ESTERS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS STABILIZERS IN BLEACHING BATHS CONTAINING ALCALINE PEROXIDE CIBA-GEIGY AG (CH) 1987-07-22 EP disclosed
EP-0210952-A1 Aqueous, alkaline, silicate-containing composition for the bleaching of cellulosic fibres in the presence of percompounds CIBA-GEIGY AG (CH) 1987-02-04 EP disclosed
EP-0210132-A1 Aqueous, alkaline, silicate-containing composition for the bleaching of cellulosic fibres in the presence of percompounds CIBA-GEIGY AG (CH) 1987-01-28 EP disclosed
EP-0082823-B1 PROCESS FOR BLEACHING FIBROUS MATERIALS WITH OLIGOMERS OF PHOSPHONIC ACIDS AS STABILIZING AGENTS IN ALCALINE, PEROXIDE-CONTAINING BLEACHING BATHS CIBA-GEIGY AG (CH) 1986-09-03 EP disclosed
US-4515597-A Magnesium complexes of oligomeric phosphonic acid esters, a process for their preparation and their use as stabilizers in alkaline, peroxide-containing bleach liquors CIBA GEIGY CORPORATION (US) 1985-05-07 US disclosed
US-4496472-A Process for bleaching cellulosic fibre materials using oligomers of phosphonic acid esters as stabilizers in alkaline, peroxide-containing bleaching liquors CIBA-GEIGY CORPORATION (US) 1985-01-29 US disclosed
EP-0112801-A1 Magnesium complexes of oligomeric phosphonic-acid esters, process for their preparation and their use as stabilizers in bleaching baths containing alcaline peroxide CIBA-GEIGY AG (CH) 1984-07-04 EP disclosed
EP-0082823-A1 Process for bleaching fibrous materials with oligomers of phosphonic acids as stabilizing agents in alcaline, peroxide-containing bleaching baths CIBA-GEIGY AG (CH) 1983-06-29 EP disclosed
US-4200489-A Process for producing sized paper or cardboard with dyes or optical brighteners and epoxide-amine-polyamide reaction products CIBA-GEIGY CORPORATION (US) 1980-04-29 US disclosed