SCHEMBL134390

SCHEMBL134390

CCCC[NH+](CCCC)CCCC.Cc1cccc([B-](c2cccc(C)c2)(c2cccc(C)c2)c2cccc(C)c2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.37
TP53 P04637 2/20 0.35
FBP1 P09467 1/20 0.35
TLR8 Q9NR97 1/20 0.34
CYP3A4 P08684 2/20 0.32
CYP2D6 P10635 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
HTT P42858 2/20 0.32
ALDH1A1 P00352 2/20 0.32
NPC1 O15118 1/20 0.32
GPX4 P36969 1/20 0.32
RAB9A P51151 1/20 0.32
PAX8 Q06710 1/20 0.32
MEN1 O00255 1/20 0.32
CRHBP P24387 1/20 0.32
KMT2A Q03164 1/20 0.32
CRHR2 Q13324 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL29871394 1.00 ACHE (0.37) ACHETP53FBP1TLR8CYP3A4
Hexane SCHEMBL31304731 0.87 ACHE (0.44) ACHETP53FBP1TLR8CYP3A4
SCHEMBL134269 0.82 NOS2 (0.31)
SCHEMBL6914559 0.81 TLR8 (0.35) ACHETP53TLR8NPC1RAB9A
SCHEMBL143787 0.80 TSHR (0.35) ALDH1A1NPC1MEN1KMT2ASMN1; SMN2
SCHEMBL1452514 0.79 ACHE (0.58) ACHETP53CYP3A4CYP2D6CYP2C9
SCHEMBL136047 0.78 HTT (0.34) ACHECYP2C9HTTALDH1A1SMN1; SMN2
Potassium Ion SCHEMBL135397 0.77 ACHE (0.55) ACHETP53CYP3A4CYP2D6CYP2C9
SCHEMBL4961104 0.77 ACHE (0.55) ACHETP53CYP3A4CYP2D6CYP2C9
SCHEMBL134691 0.77 ACHE (0.55) ACHETP53CYP3A4CYP2D6CYP2C9

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 631 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3239190-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING Chevron Phillips Chemical Company LP (US) 2017-11-01 EP claimed
EP-2235069-B1 NANO-LINKED METALLOCENE CATALYST COMPOSITIONS AND THEIR POLYMER PRODUCTS CHEVRON PHILLIPS CHEMICAL CO (US) 2015-11-25 EP claimed
EP-2231717-B1 NANO-LINKED METALLOCENE CATALYST COMPOSITIONS AND THEIR POLYMER PRODUCTS CHEVRON PHILLIPS CHEMICAL CO (US) 2015-10-21 EP claimed
EP-2231716-B1 NANO-LINKED METALLOCENE CATALYST COMPOSITIONS AND THEIR POLYMER PRODUCTS CHEVRON PHILLIPS CHEMICAL CO (US) 2014-04-16 EP claimed
US-8524626-B2 Nano-linked metallocene catalyst compositions and their polymer products CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2013-09-03 US claimed
US-8329833-B2 Nano-linked metallocene catalyst compositions and their polymer products CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-12-11 US claimed
US-20120149855-A1 Nano-Linked Metallocene Catalyst Compositions and Their Polymer Products CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-06-14 US claimed
US-8143183-B2 Nano-linked metallocene catalyst compositions and their polymer products CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-03-27 US claimed
US-20120058886-A1 Nano-Linked Metallocene Catalyst Compositions and Their Polymer Products CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-03-08 US claimed
US-8012900-B2 Nano-linked metallocene catalyst compositions and their polymer products CHEVRON PHILLIPS CHEMICAL COMPANY, L.P. (US) 2011-09-06 US claimed
US-6982306-B2 Stannoxy-substituted metallocene catalysts for olefin and acetylene polymerization CHEVRON PHILLIPS CHEMICAL COMPANY, L.P. (US) 2006-01-03 US claimed
US-20050288462-A1 Polymerization catalysts for producing polymers with low levels of long chain branching CHEVRON PHILIPS CHEMICAL COMPANY, L.P. 2005-12-29 US claimed
US-20050288461-A1 Polymerization catalysts for producing polymers with low levels of long chain branching CHEVRON PHILLIPS CHEMICAL COMPANY, L.P. 2005-12-29 US claimed
WO-2005070977-A1 DUAL METALLOCENE CATALYST FOR PRODUCING FILM RESINS WITH GOOD MACHINE DIRECTION (MD) ELMENDORF TEAR STRENGTH CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2005-08-04 WO claimed
WO-2005068519-A2 CATALYST COMPOSITIONS AND POLYOLEFINS FOR EXTRUSION COATING APPLICATIONS CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2005-07-28 WO claimed
US-20050159300-A1 Dual metallocene catalyst for producing film resins with good machine direction (MD) elmendorf tear strength CHEVRON PHILLIPS CHEMICAL COMPANY LP 2005-07-21 US claimed
US-20050153830-A1 contact product of a first metallocene compound, a second metallocene compound, a chemically-treated solid oxide, and an organoaluminum compound; useful properties in impact, tear, adhesion, sealing, extruder motor loads and pressures at comparable melt index values, and neck-in and draw-down. CHEVRON PHILIPS CHEMICAL COMPANY LP 2005-07-14 US claimed
WO-2005052011-A1 CATALYST COMPOSITIONS FOR PRODUCING POLYOLEFINS IN THE ABSENCE OF COCATALYSTS CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2005-06-09 WO claimed
US-20050113245-A1 STANNOXY-SUBSTITUTED METALLOCENE CATALYSTS FOR OLEFIN AND ACETYLENE POLYMERIZATION CHEVRON PHILLIPS CHEMICAL COMPANY LP 2005-05-26 US claimed
US-20050113243-A1 Catalyst compositions for producing polyolefins in the absence of cocatalysts CHEVRON PHILLIPS CHEMICAL COMPANY, LP 2005-05-26 US claimed