SCHEMBL6064054

SCHEMBL6064054

OCCN1CCCCC1c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 1/20 0.50
▸ CHRNB4 P30926 1/20 0.50
▸ CHRNA3 P32297 1/20 0.50
▸ CHRNA7 P36544 1/20 0.50
▸ CHRNA4 P43681 1/20 0.50
▸ SLC18A3 Q16572 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ CFB P00751 2/20 0.44
▸ PDK1 Q15118 1/20 0.43
▸ PDK2 Q15119 1/20 0.43
▸ PDK3 Q15120 1/20 0.43
▸ PDK4 Q16654 1/20 0.43
▸ OPRM1 P35372 1/20 0.41
▸ OPRL1 P41146 1/20 0.41
▸ NR1H4 Q96RI1 1/20 0.41

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
SCHEMBL583720 0.95 CHRNB2 (0.56) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
Hydrochloric Acid SCHEMBL8017797 0.93 CHRNB2 (0.54) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL18751632 0.90 CHRNB2 (0.56) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL11819504 0.86 ALDH1A1 (0.50) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL3589627 0.85 CHRNB2 (0.53) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL4318786 0.83 CHRNB2 (0.54) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL4714894 0.83 CHRNB2 (0.50) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL11509424 0.82 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
Benzene SCHEMBL11161088 0.81 CHRNB2 (0.55) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL27512084 0.81 CHRNB2 (0.55) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7087549-B2 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-08-08 — — US claimed
US-20050181935-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2005-08-18 — — US claimed
EP-0990670-B1 Calcium-based catalyst system GOODYEAR TIRE & RUBBER (US) 2004-11-03 — — EP claimed
US-20020045720-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2002-04-18 — — US claimed
US-6359088-B1 COPOLYMERIZING STYRENE AND 1,3-BUTADIENE IN AN ORGANIC SOLVENT IN THE PRESENCE OF CATALYST SYSTEM WHICH CONSISTS ESSENTIALLY OF AN ORGANOLITHIUM COMPOUND, A CALCIUM ALKOXIDE AND A LITHIUM ALKOXIDE THE GOODYEAR TIRE & RUBBER COMPANY 2002-03-19 — — US claimed
US-6103842-A USING CATALYST SYSTEM FOR EXOTHERMAL POLYMERIZATION WHICH CONSISTS ESSENTIALLY OF (A) AN ORGANOLITHIUM COMPOUND, (B) A BARIUM ALKOXIDE AND (C) A LITHIUM ALKOXIDE THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-08-15 — — US claimed
EP-0990670-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-04-05 — — EP claimed
EP-0391692-B1 Process for producing high trans low vinyl conjugated diene (co) polymer JAPAN SYNTHETIC RUBBER CO LTD (JP) 1994-01-05 — — EP claimed
US-5086136-A Using coordination catalyst containing organoaluminum compound, barium compound and alcohol JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-02-04 — — US claimed
EP-0391692-A1 Process for producing high trans low vinyl conjugated diene (co) polymer JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1990-10-10 — — EP claimed
US-7087549-B2 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-08-08 — — US disclosed
US-20050181935-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2005-08-18 — — US disclosed
EP-0990670-B1 Calcium-based catalyst system GOODYEAR TIRE & RUBBER (US) 2004-11-03 — — EP disclosed
US-20020045720-A1 Calcium-based catalyst system THE GOODYEAR TIRE & RUBBER COMPANY 2002-04-18 — — US disclosed
US-6359088-B1 COPOLYMERIZING STYRENE AND 1,3-BUTADIENE IN AN ORGANIC SOLVENT IN THE PRESENCE OF CATALYST SYSTEM WHICH CONSISTS ESSENTIALLY OF AN ORGANOLITHIUM COMPOUND, A CALCIUM ALKOXIDE AND A LITHIUM ALKOXIDE THE GOODYEAR TIRE & RUBBER COMPANY 2002-03-19 — — US disclosed
US-5086136-A Using coordination catalyst containing organoaluminum compound, barium compound and alcohol JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-02-04 — — US disclosed
EP-0331400-B1 CATALYST COMPOSITION FOR POLYMERIZATION OF CONJUGATED DIENE AND PROCESS FOR PRODUCING CONJUGATED DIENE POLYMER JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1992-01-08 — — EP disclosed
EP-0391692-A1 Process for producing high trans low vinyl conjugated diene (co) polymer JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1990-10-10 — — EP disclosed
US-4933401-A ORGANO-LITHIUM-ALUMINUM COMPOUND JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1990-06-12 — — US disclosed
EP-0331400-A1 Catalyst composition for polymerization of conjugated diene and process for producing conjugated diene polymer JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1989-09-06 — — EP disclosed
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