SCHEMBL5200151

SCHEMBL5200151

C=Cc1ccc(C(OC)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
TSHR P16473 2/20 0.48
CYP19A1 P11511 1/20 0.40
MAPK1 P28482 1/20 0.34
TRPA1 O75762 2/20 0.34
CES1 P23141 1/20 0.34
KCNN4 O15554 1/20 0.33
KIF11 P52732 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
ALOX15 P16050 1/20 0.32
HDAC6 Q9UBN7 2/20 0.32
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
CYP3A4 P08684 1/20 0.31
TP53 P04637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31

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
Methoxytriphenylmethane SCHEMBL9103 0.81 MAPK1 (0.48) ALDH1A1TSHRCYP19A1MAPK1CES1
SCHEMBL5198302 0.80 ALDH1A1 (0.43) ALDH1A1TSHRKIF11HDAC6CHRNB2
Methoxytriphenylmethane SCHEMBL27882817 0.79 MAPK1 (0.46) ALDH1A1TSHRCYP19A1MAPK1CES1
SCHEMBL3337526 0.78 ALDH1A1 (0.54) ALDH1A1TSHRMAPK1HDAC8ESR1
SCHEMBL28338264 0.78 ALDH1A1 (0.54) ALDH1A1TSHRCYP19A1MAPK1KCNN4
SCHEMBL5199756 0.77 ALDH1A1 (0.48) ALDH1A1TSHRMAPK1TRPA1KIF11
Styrene SCHEMBL9614272 0.75 ALDH1A1 (0.64) ALDH1A1TSHRMAPK1TRPA1HDAC8
SCHEMBL8785784 0.75 CYP19A1 (0.44) TSHRCYP19A1MAPK1CES1KCNN4
SCHEMBL5198672 0.75 KIF11 (0.45) ALDH1A1TSHRCYP19A1KIF11CHRNB2
SCHEMBL29066407 0.74 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1HDAC8ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1481981-B1 Styrene hypophosphite adduct, preparation thereof and use CLARIANT PRODUKTE DEUTSCHLAND (DE) 2007-08-15 EP disclosed
US-7220791-B2 Styrene-hypophosphite adduct, a process for preparation thereof, and its use CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2007-05-22 US disclosed
US-20040242738-A1 Styrene-hypophosphite adduct, a process for preparation thereof, and its use CLARIANT GMBH 2004-12-02 US disclosed
EP-1481981-A2 Styrene hypophosphite adduct, preparation thereof and use Clariant GmbH (DE) 2004-12-01 EP disclosed
US-6486272-B1 METAL COMPOUND INTERACTS WITH A VINYL COMPOUND WITH A FUNCTIONAL GROUP TO MASK IT AND COPOLYMERIZING WITH A STYRENE IN THE PRESENCE OF TRANSITION METAL COMPOUND, OXYGEN COMPOUNDS WHICH FORM IONIC COMPLEXES, AND AN ORGANOMETALLIC COMPOUND IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2002-11-26 US disclosed
US-20020173605-A1 PROCESS FOR PRODUCING FUNCTIONAL STYRENE COPOLYMER AND FUNCTIONAL STYRENE COPOLYMER IDEMITSU KOSAN CO.,LTD. (JP) 2002-11-21 US disclosed
EP-1219649-A1 PROCESS FOR PRODUCING FUNCTIONAL STYRENE COPOLYMER AND FUNCTIONAL STYRENE COPOLYMER IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2002-07-03 EP disclosed