SCHEMBL2422358

SCHEMBL2422358

C1=CCC([Ba]C2=CC=CC2)=C1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8351749 0.79
Tetrahydrofuran SCHEMBL8353807 0.68 ALDH1A1 (0.35)
SCHEMBL10608987 0.65
SCHEMBL2295348 0.62
SCHEMBL7082901 0.62
SCHEMBL27884552 0.62
SCHEMBL3187920 0.62
SCHEMBL315517 0.62
SCHEMBL285185 0.61
SCHEMBL28966292 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6579509-B1 Method of cleaning of harmful gas and cleaning apparatus JAPAN PIONICS CO., LTD. (JP) 2003-06-17 US claimed
US-6473563-B2 Vaporizer and apparatus for vaporizing and supplying JAPAN PIONICS CO., LTD. (JP) 2002-10-29 US claimed
US-20020067917-A1 Vaporizer and apparatus for vaporizing and supplying JAPAN PIONICS CO., LTD. (JP) 2002-06-06 US claimed
EP-1211333-A2 Vaporizer for CVD apparatus JAPAN PIONICS CO., LTD. (JP) 2002-06-05 EP claimed
US-4092268-A POLYMERIZATION CATALYST OF AN ORGANO-LITHIUM INITIATOR, A BARIUM OR STRONTIUM COMPOUND, AND AN ORGANOMETALLIC ALUMINUM OR ZINC COMPOUND COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN, RAISON SOCIALE MICHELIN & CIE (FR) 1978-05-30 US claimed
US-4080492-A ORGANOLITHIUM INITIATOR AND COCATALYST CONTAINING BARIUM OR STRONTIUM COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 1978-03-21 US claimed
JP-63319038-A None JP disclosed
EP-1880412-B1 METHOD FOR FORMING HIGH-RESOLUTION PATTERN WITH DIRECT WRITING MEANS LG CHEMICAL LTD (KR) 2017-11-29 EP disclosed
CN-104945444-A Raw material for preparing barium metallocene complex and preparation method of barium metallocene complex GUANGDONG DANBOND TECHNOLOGY CO LTD 2015-09-30 CN disclosed
US-8026510-B2 Organic electronic device and method for producing the same DAI NIPPON PRINTING CO., LTD. (JP) 2011-09-27 US disclosed
US-7625983-B2 Process for the preparation of block copolymers for tire tread compositions and these copolymers Michelin-Recherche et Technique S.A. (CH) 2009-12-01 US disclosed
US-7510951-B2 Method for forming high-resolution pattern with direct writing means LG CHEM, LTD. (KR) 2009-03-31 US disclosed
US-7504454-B2 Process for the preparation of block copolymers for tire tread compositions, and these copolymers MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2009-03-17 US disclosed
EP-0323145-A1 Equipment and method for supply of organic metal compound MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-07-05 EP disclosed
JP-S63319038-A APPARATUS FOR VACUUM CHEMICAL REACTION ANELVA CORP 1988-12-27 JP disclosed
EP-0061902-B1 PROCESS FOR PRODUCING CONJUGATED DIENE POLYMER Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1985-06-12 EP disclosed
US-4446290-A SODIUM OR ORGANOSODIUM COMPOUND, OTHER ORGANOMETALLIC COMPOUNDS, COMPLEXES ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1984-05-01 US disclosed
EP-0061902-A1 Process for producing conjugated diene polymer Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-10-06 EP disclosed
US-4092268-A POLYMERIZATION CATALYST OF AN ORGANO-LITHIUM INITIATOR, A BARIUM OR STRONTIUM COMPOUND, AND AN ORGANOMETALLIC ALUMINUM OR ZINC COMPOUND COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN, RAISON SOCIALE MICHELIN & CIE (FR) 1978-05-30 US disclosed
US-4080492-A ORGANOLITHIUM INITIATOR AND COCATALYST CONTAINING BARIUM OR STRONTIUM COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 1978-03-21 US disclosed