SCHEMBL1964126

SCHEMBL1964126

CCCCCC(CCC)c1ccc(O)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.42
KDM4E B2RXH2 4/20 0.42
MAPK1 P28482 3/20 0.42
SHBG P04278 1/20 0.42
MAPT P10636 4/20 0.41
ADRB2 P07550 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
RECQL P46063 3/20 0.41
APEX1 P27695 3/20 0.41
PTGS2 P35354 3/20 0.41
ADRB1 P08588 2/20 0.41
CYP3A4 P08684 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
ADRB3 P13945 2/20 0.41
DRD2 P14416 2/20 0.41
ADRA2B P18089 2/20 0.41
ADRA2C P18825 2/20 0.41
DRD1 P21728 2/20 0.41

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
SCHEMBL30918750 0.85 TDP1 (0.49) TDP1KDM4EMAPK1MAPTADRB2
SCHEMBL29196543 0.85 TDP1 (0.49) TDP1KDM4EMAPK1MAPTADRB2
SCHEMBL340352 0.84 ESR1 (0.42) TDP1KDM4EMAPK1SHBGADRB2
SCHEMBL8821813 0.84 CA1 (0.39) CYP3A4ALDH1A1TSHRHSD17B10ESR1
SCHEMBL22198693 0.84 SHBG (0.49) TDP1SHBGMAPTMEN1KMT2A
SCHEMBL19425427 0.84 TDP1 (0.50) TDP1KDM4EMAPK1SHBGMAPT
SCHEMBL27589765 0.83 TYR (0.43) TDP1MAPTMEN1KMT2ACYP3A4
SCHEMBL11218392 0.83 TDP1 (0.42) TDP1KDM4EMAPK1SHBGMAPT
SCHEMBL8847942 0.82 MAPT (0.56) TDP1KDM4EMAPK1MAPTADRB2
SCHEMBL29161607 0.82 GPR84 (0.45) APPIAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200299556-A1 COACERVATE FORMED FROM CATECHOL-SUBSTITUTED ANIONIC POLYMER, ADHESIVE COMPRISING SAME, AND METHOD FOR PRODUCING SAME POSTECH ACADEMY-INDUSTRY FOUNDATION (KR) 2020-09-24 US disclosed
EP-2334767-B1 FATTY ESTER COMPOSITIONS WITH IMPROVED OXIDATIVE STABILITY TAMINCO (BE) 2013-05-29 EP disclosed
US-20110154724-A1 FATTY ESTER COMPOSITIONS WITH IMPROVED OXIDATIVE STABILITY TAMINCO (BE) 2011-06-30 US disclosed
EP-2334767-A1 FATTY ESTER COMPOSITIONS WITH IMPROVED OXIDATIVE STABILITY Taminco (BE) 2011-06-22 EP disclosed
WO-2010023277-A1 FATTY ESTER COMPOSITIONS WITH IMPROVED OXIDATIVE STABILITY TAMINCO (BE) 2010-03-04 WO disclosed
US-7582126-B2 Fatty ester compositions with improved oxidative stability ARKEMA FRANCE (FR) 2009-09-01 US disclosed
WO-2007078452-A2 FATTY ESTER COMPOSITIONS WITH IMPROVED OXIDATIVE STABILITY ARKEMA FRANCE (FR) 2007-07-12 WO disclosed
US-20070137098-A1 Fatty ester compositions with improved oxidative stability ARKEMA FRANCE (FR) 2007-06-21 US disclosed
US-4456526-A USING A N,N-DIALKYLHYDROXLAMINE AND A TERTIARY-ALKYLCATECHOL ATLANTIC RICHFIELD COMPANY (US) 1984-06-26 US disclosed
US-4434307-A N,N-DIARYLHYDROXYLAMINE, MONO-OR DI-TERT-BUTYL CATECHOL OR HYDROQUINONE ATLANTIC RICHFIELD COMPANY (US) 1984-02-28 US disclosed
US-4409408-A DIALKYLHYDROXYLAMINES, TERT-ALKYL CATECHOLS ATLANTIC RICHFIELD COMPANY (US) 1983-10-11 US disclosed