SCHEMBL539317

SCHEMBL539317

C[NH+](C)c1ccccc1.Cc1cccc([Al-](c2cccc(C)c2)(c2cccc(C)c2)c2cccc(C)c2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.39
NPSR1 Q6W5P4 1/20 0.37
TSHR P16473 2/20 0.36
LMNA P02545 1/20 0.36
ALOX12 P18054 1/20 0.36
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
KIF11 P52732 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KCNH2 Q12809 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
PARP1 P09874 1/20 0.32
TAAR1 Q96RJ0 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
SCHEMBL538803 0.85 ACHE (0.33) ACHETSHRLMNAALOX12
SCHEMBL5085715 0.82
Potassium Ion SCHEMBL134408 0.82 ACHE (0.58) ACHENPSR1TSHRLMNAALOX12
SCHEMBL1450779 0.82 ACHE (0.58) ACHENPSR1TSHRLMNAALOX12
Lithium Ion SCHEMBL136597 0.80 ACHE (0.55) ACHENPSR1TSHRALDH1A1MAPK1
SCHEMBL137227 0.80 ACHE (0.55) ACHENPSR1TSHRALDH1A1MAPK1
SCHEMBL538790 0.79 LMNA (0.40) ACHETSHRLMNAALOX12ALDH1A1
SCHEMBL539209 0.76 ACHE (0.41) ACHENPSR1TSHRLMNAALOX12
SCHEMBL134649 0.74 ACHE (0.39) ACHENPSR1TSHRLMNAALOX12
SCHEMBL29614954 0.74 ACHE (0.39) ACHENPSR1TSHRLMNAALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1706437-B1 DUAL METALLOCENE CATALYST FOR PRODUCING FILM RESINS WITH GOOD MACHINE DIRECTION (MD) ELMENDORF TEAR STRENGTH CHEVRON PHILLIPS CHEMICAL CO (US) 2016-01-20 EP claimed
EP-1711543-B1 CATALYST COMPOSITIONS AND POLYOLEFINS FOR EXTRUSION COATING APPLICATIONS CHEVRON PHILLIPS CHEMICAL CO (US) 2011-08-24 EP claimed
EP-1773899-B1 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING CHEVRON PHILLIPS CHEMICAL CO (US) 2009-02-11 EP claimed
JP-2007520597-A 2007-07-26 JP claimed
JP-2007518871-A 2007-07-12 JP claimed
EP-1778749-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING Chevron Phillips Chemical Company LP (US) 2007-05-02 EP claimed
EP-1773899-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING Chevron Phillips Chemical Company LP (US) 2007-04-18 EP claimed
US-7199073-B2 Resins that yield low haze films and the process for their production CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2007-04-03 US claimed
US-7148298-B2 Polymerization catalysts for producing polymers with low levels of long chain branching CHEVRON PHILLIPS CHEMICAL COMPANY, L.P. (US) 2006-12-12 US claimed
EP-1711543-A2 CATALYST COMPOSITIONS AND POLYOLEFINS FOR EXTRUSION COATING APPLICATIONS Chevron Phillips Chemical Company LP (US) 2006-10-18 EP claimed
WO-2006004789-A2 POLYMERIZATION CATALYSTS FOR PRODUCING POLYMERS WITH LOW LEVELS OF LONG CHAIN BRANCHING CHEVRON PHILLIPS CHEMICAL COMPANY, LP (US) 2006-01-12 WO 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
US-20050113243-A1 Catalyst compositions for producing polyolefins in the absence of cocatalysts CHEVRON PHILLIPS CHEMICAL COMPANY, LP 2005-05-26 US claimed
US-20050113245-A1 STANNOXY-SUBSTITUTED METALLOCENE CATALYSTS FOR OLEFIN AND ACETYLENE POLYMERIZATION CHEVRON PHILLIPS CHEMICAL COMPANY LP 2005-05-26 US claimed