SCHEMBL616673

SCHEMBL616673

C1=CC([Zr+2]2(C3C=Cc4ccccc43)CC2)c2ccccc21.CS(=O)(=O)[O-].CS(=O)(=O)[O-]

nearest known ligand 0.33

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.33
CCL2 P13500 1/20 0.33
SIGMAR1 Q99720 2/20 0.31
PTGS2 P35354 1/20 0.30

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
SCHEMBL6357318 0.89 HTR2A (0.33) BRD4CCL2SIGMAR1
SCHEMBL617385 0.87 FFAR4 (0.35)
Hydrochloric Acid SCHEMBL8017987 0.87 HTR6 (0.33) BRD4CCL2SIGMAR1
Trifluoromethanesulfonic Acid SCHEMBL619015 0.87 GPR3 (0.36)
SCHEMBL5839790 0.85 HTR2A (0.35)
Hydrochloric Acid SCHEMBL648408 0.85 HTR2A (0.35)
Hydrochloric Acid SCHEMBL151866 0.85 HTR2A (0.35)
Bromide SCHEMBL616105 0.85 HTR2A (0.39)
Fluoride Ion SCHEMBL1130929 0.85 HTR2A (0.35)
SCHEMBL7110550 0.83 HTR6 (0.33) BRD4CCL2SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10087262-B2 Ethylene polymer, stretch-molded product obtained by stretching the same, and method for producing ethylene polymer ASAHI KASEI KABUSHIKI KAISHA (JP) 2018-10-02 US disclosed
US-20170298156-A1 ETHYLENE POLYMER, STRETCH-MOLDED PRODUCT OBTAINED BY STRETCHING THE SAME, AND METHOD FOR PRODUCING ETHYLENE POLYMER ASAHI KASEI KABUSHIKI KAISHA (JP) 2017-10-19 US disclosed
EP-2423236-B1 METHOD FOR PRODUCING OLEFIN POLYMER MITSUI CHEMICALS INC (JP) 2013-09-04 EP disclosed
US-8507603-B2 Solvent dispersion of composite resin and uses thereof MITSUI CHEMICALS, INC. (JP) 2013-08-13 US disclosed
US-8445609-B2 Method for producing olefin polymer MITSUI CHEMICALS, INC. (JP) 2013-05-21 US disclosed
EP-2423236-A1 METHOD FOR PRODUCING OLEFIN POLYMER Mitsui Chemicals, Inc. (JP) 2012-02-29 EP disclosed
US-20120041162-A1 METHOD FOR PRODUCING OLEFIN POLYMER PRIME POLYMER CO., LTD. 2012-02-16 US disclosed
US-20110054118-A1 Solvent dispersion of composite resin and uses thereof MITSUI CHEMICALS, INC. (JP) 2011-03-03 US disclosed
US-7879950-B2 Solvent dispersion of composite resin and uses thereof MITSUI CHEMICALS, INC. (JP) 2011-02-01 US disclosed
US-20070245929-A1 Solvent Dispersion of Composite Resin and Uses Thereof MITSUI CHEMICALS, INC. (JP) 2007-10-25 US disclosed
EP-0587365-A2 Ethylene copolymer composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-03-16 EP disclosed
US-5292845-A Ethylene/alpha-olefin/7-methyl-1,6-octadiene copolymer rubber and composition of the same MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-03-08 US disclosed
EP-0575123-A2 Ethylene copolymer composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-12-22 EP disclosed
US-5252529-A Coordination catalyst using a moisture-adsorbed carrier of a metal oxide; addition polymers having excellent melt tension and moldability and broad molecular weight distribution MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-10-12 US disclosed
EP-0552946-A1 Ethylene/alpha-olefin/7-methyl-1,6-octadiene copolymer rubber and composition of the same MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-07-28 EP disclosed
EP-0552945-A2 Process for the preparation of polyolefin MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-07-28 EP disclosed
EP-0536503-A2 Olefin polymer composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-04-14 EP disclosed
EP-0534119-A2 Prepolymerized olefin polymerization catalyst and olefin polymerization process MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1993-03-31 EP disclosed
EP-0516458-A2 Olefin polymerization solid catalyst, olefin polymerization catalyst and olefin polymerization MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-12-02 EP disclosed
EP-0515132-A2 Olefin polymerization catalyst and olefin polymerization MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-11-25 EP disclosed