SCHEMBL1553827

SCHEMBL1553827

OB(OC1CCCCC1)OC1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA12 O43570 2/20 0.44
CA9 Q16790 2/20 0.44
EPHX1 P07099 2/20 0.34
NAAA Q02083 2/20 0.33
NPC1 O15118 1/20 0.31
CES2 O00748 1/20 0.30
CES1 P23141 1/20 0.30
CYP2C19 P33261 1/20 0.30
ACHE P22303 1/20 0.30
TSHR P16473 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
SCHEMBL29433 0.97 CA1 (0.42) CA1CA2CA12CA9EPHX1
SCHEMBL29432 0.97 CA1 (0.42) CA1CA2CA12CA9EPHX1
SCHEMBL3889052 0.97 CA1 (0.42) CA1CA2CA12CA9EPHX1
SCHEMBL11387784 0.87 CA1 (0.37) CA1CA2CA12CA9
SCHEMBL27941341 0.87 CA12 (0.37) CA1CA2CA12CA9
SCHEMBL6460374 0.85 CA12 (0.35) CA1CA2CA12CA9
SCHEMBL29161823 0.85 CA1 (0.37) CA1CA2CA12CA9EPHX1
SCHEMBL2341384 0.85 CA1 (0.37) CA1CA2CA12CA9EPHX1
SCHEMBL30838769 0.85 CA1 (0.37) CA1CA2CA12CA9EPHX1
SCHEMBL1014426 0.85 CA1 (0.37) CA1CA2CA12CA9EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118974007-A Tetrahydronaphthalene derivatives 阿创森制药股份有限公司 2024-11-15 CN disclosed
CN-117545759-A Derivatives of dihydroxyborylphenylalanine 斯特拉制药公司 2024-02-09 CN disclosed
CN-110372482-B Poplar canula moth sex pheromone active ingredient and preparation and identification method thereof 中国林业科学研究院森林生态环境与保护研究所 2022-05-17 CN disclosed
CN-109963852-B Oxoisoquinoline derivatives 卡尔那生物科学株式会社 2021-12-03 CN disclosed
CN-111722491-A External additive for toner and toner 佳能株式会社 2020-09-29 CN disclosed
CN-111302918-A Stereoselective synthesis method of (Z, E) -13, 15-octadecadienal 中国林业科学研究院森林生态环境与保护研究所 2020-06-19 CN disclosed
CN-110372482-A A kind of micromelalopha troglodyte sex pheromone active constituent and its preparation and authentication method 中国林业科学研究院森林生态环境与保护研究所 2019-10-25 CN disclosed
CN-104216246-A Magnetic carrier, two-component developer, developer for replenishment, and image forming method CANON KK 2014-12-17 CN disclosed
EP-1711863-B1 POSITIVE CHARGEABLE MAGNETIC TONER COMPOSITION AND USE THEREOF LG CHEMICAL LTD (KR) 2011-04-27 EP disclosed
US-7833331-B2 Non-toxic corrosion-protection pigments based on cobalt UNIVERSITY OF DAYTON (US) 2010-11-16 US disclosed
US-6652608-B1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2003-11-25 US disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
CN-1428660-A Toner for electrostatic charge image developing and imaging method using the toner TOYO INK MFG CO (JP) 2003-07-09 CN disclosed
CN-1332080-A Method for producing moulded product with excellent blocking performance KURARAY CO (JP) 2002-01-23 CN disclosed
EP-1051461-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR, William C. (US) 2000-11-15 EP disclosed
WO-1999066009-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR WILLIAM C (US) 1999-12-23 WO disclosed
EP-0954558-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR, William C. (US) 1999-11-10 EP disclosed
WO-1998026028-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 1998-06-18 WO disclosed