SCHEMBL1949545

SCHEMBL1949545

COc1ccc(N(C(C)=O)c2cc(N(C(C)=O)c3ccc(OC)c(OC)c3)cc(N(C(C)=O)c3ccc(OC)c(OC)c3)c2)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
CA12 O43570 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA7 P43166 2/20 0.46
CA9 Q16790 2/20 0.46
CA14 Q9ULX7 2/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
TPMT P51580 1/20 0.46
GAA P10253 3/20 0.45
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MAPT P10636 3/20 0.42

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
SCHEMBL28618233 0.79 HTT (0.48) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL12574089 0.78 TUBB1 (0.43) TSHRCYP3A4GAAALDH1A1MEN1
SCHEMBL28607273 0.77 KMT2A (0.45) TSHRCYP1A2CYP2C9CYP2C19GAA
SCHEMBL14027974 0.76 TSHR (0.64) TSHRALDH1A1MEN1KMT2APOLB
SCHEMBL28332018 0.75 POLB (0.55) TSHRCA12CA1CA2CA7
SCHEMBL28607669 0.75 PLK1 (0.47) TSHRGAAALDH1A1MEN1KMT2A
SCHEMBL27501307 0.75 MEN1 (0.59) TSHRCYP1A2ALDH1A1MEN1KMT2A
SCHEMBL13503685 0.72 KMT2A (0.52) TSHRMEN1KMT2APOLB
SCHEMBL8943682 0.72 CA2 (0.58) TSHRCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL10817091 0.71 SLC22A6 (0.42) TSHRCYP1A2CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1592738-B1 RESIN COMPOSITIONS CIBA HOLDING INC (CH) 2020-07-29 EP disclosed
US-9029446-B2 Clarified polypropylene articles with improved optical properties and/or increased temperature of crystallization BASF SE (DE) 2015-05-12 US disclosed
EP-2510047-B1 CLARIFIED POLYPROPYLENE ARTICLES WITH IMPROVED OPTICAL PROPERTIES AND/OR INCREASED TEMPERATURE OF CRYSTALLIZATION BASF SE (DE) 2014-11-05 EP disclosed
US-8415416-B2 Electret materials BASF SE (DE) 2013-04-09 US disclosed
US-20130012091-A1 Electret Materials BASF SE (DE) 2013-01-10 US disclosed
US-20120184170-A1 Electret Materials CHIN HUI (US) 2012-07-19 US disclosed
US-20110136950-A1 Clarified Polypropylene Articles with Improved Optical Properties and/or increased temperature of Crystallization BASF SE (DE) 2011-06-09 US disclosed
US-7790793-B2 Amide nucleating agent compositions CIBA SPECIALTY CHEM. CORP. (US) 2010-09-07 US disclosed
US-20080249269-A1 Electret materials CIBA CORP. 2008-10-09 US disclosed
US-20070149663-A1 Resin compositions CIBA SPECIALTY CHEMICALS CORP. 2007-06-28 US disclosed
EP-1592738-A2 RESIN COMPOSITIONS Ciba SC Holding AG (CH) 2005-11-09 EP disclosed
WO-2004072168-A2 RESIN COMPOSITIONS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-08-26 WO disclosed