SCHEMBL73173

SCHEMBL73173

CC1(C)CC(CC2CCCCC2)CCC1(N)N

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATP1A1 P05023 2/20 0.34
ATP1B1 P05026 2/20 0.34
ATP1A3 P13637 2/20 0.34
ATP1B2 P14415 2/20 0.34
ATP1A2 P50993 2/20 0.34
ATP1B3 P54709 2/20 0.34
FXYD2 P54710 2/20 0.34
ATP1A4 Q13733 2/20 0.34
SIGMAR1 Q99720 4/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 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
SCHEMBL9063863 0.93 ATP1A1 (0.32) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL11165385 0.90
SCHEMBL5482308 0.85 ATP1A1 (0.34) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL8089126 0.81 ATP1A1 (0.32) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL16619589 0.79 NOS1 (0.32) NOS1NOS2
SCHEMBL28278311 0.76 POLB (0.33)
Ethane SCHEMBL27621691 0.74 NOS1 (0.34) SIGMAR1NOS1NOS2
SCHEMBL36965 0.73 NOS1 (0.36) SIGMAR1NOS1NOS2
SCHEMBL5189141 0.72 ATP1A1 (0.34) ATP1A1ATP1B1ATP1A3ATP1B2ATP1A2
SCHEMBL5482825 0.72 NOS1 (0.33) SIGMAR1NOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115975181-B Ternary polymerization transparent nylon and preparation method thereof 华润化学材料科技股份有限公司 2024-02-13 CN claimed
CN-117343267-A Enclosed polyurethane composition and preparation method and application thereof 上海华峰新材料研发科技有限公司 2024-01-05 CN claimed
CN-117127276-A Bio-based spandex elastic fiber and preparation method thereof 华峰化学股份有限公司 2023-11-28 CN claimed
CN-116875257-A Colorless transparent low-hardness yellowing-resistant adhesive and preparation method thereof 深圳市安伯斯科技有限公司 2023-10-13 CN claimed
CN-115975181-A Terpolymer transparent nylon and preparation method thereof 华润化学材料科技股份有限公司 2023-04-18 CN claimed
CN-115626972-A Water-based high-molecular phosphate and preparation method and application thereof 重庆宏国聚材科技有限责任公司 2023-01-20 CN claimed
CN-115572364-A Solvent type high-molecular phosphate and preparation method and application thereof 重庆宏国聚材科技有限责任公司 2023-01-06 CN claimed
CN-115181487-A Concrete floor tortoise crack polymer repairing agent 星地元新材料股份有限公司 2022-10-14 CN claimed
CN-115010895-A Blocked polyurethane resin composition and preparation method and application thereof 上海华峰新材料研发科技有限公司 2022-09-06 CN claimed
CN-114752331-A Low-cost water-resistant epoxy crack sealer 湖南浩森胶业有限公司 2022-07-15 CN claimed
EP-1218464-A1 CHEMICAL MECHANICAL POLISHING SYSTEMS AND METHODS FOR THEIR USE Cabot Microelectronics Corporation (US) 2002-07-03 EP claimed
WO-2001012741-A1 POLISHING SYSTEM WITH STOPPING COMPOUND AND METHOD OF ITS USE CABOT MICROELECTRONICS CORPORATION (US) 2001-02-22 WO claimed
WO-2001012739-A1 CHEMICAL MECHANICAL POLISHING SYSTEMS AND METHODS FOR THEIR USE CABOT MICROELECTRONICS CORPORATION (US) 2001-02-22 WO claimed
WO-1998037145-A1 COMPOSITION FOR COATING, SEALING AND PROTECTION PURPOSES PROCOAT AB (SE) 1998-08-27 WO claimed
EP-0860486-A1 Composition for coating, sealing and protection purposes Procoat Aktiebolag (SE) 1998-08-26 EP claimed
EP-0816326-A1 Process for preparing mono- and polyspartic acid esters BAYER AG (DE) 1998-01-07 EP claimed
EP-0542766-B1 PROCESS FOR PRODUCING CLOSURES OF PACKAGING CONTAINERS BASF LACKE & FARBEN (DE) 1996-01-24 EP claimed
EP-0459989-B1 PROCESS FOR THE PRODUCTION OF CLOSURES FOR PACKAGING CONTAINERS BASF LACKE & FARBEN (DE) 1995-07-26 EP claimed
US-5384169-A Sealing food, beverage and chemical packages, reaction product of diisocyanate and polyamine BASF LACKE + FARBEN AKTIENGESELLSCHAFT (DE) 1995-01-24 US claimed
WO-1990010041-A1 PROCESS FOR THE PRODUCTION OF CLOSURES FOR PACKAGING CONTAINERS BASF LACKE + FARBEN AKTIENGESELLSCHAFT (DE) 1990-09-07 WO claimed