SCHEMBL7563468

SCHEMBL7563468

CCCCCCCCCCC(C1CC(C)(C)NC(C)(C)C1)C(OC(=O)CC(C(=O)OC(C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C(CCCCCCCCCC)C1CC(C)(C)NC(C)(C)C1)C(CC(=O)OC(C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C(CCCCCCCCCC)C1CC(C)(C)NC(C)(C)C1)C(=O)OC(C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C(CCCCCCCCCC)C1CC(C)(C)NC(C)(C)C1)(C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)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
SCHEMBL7563476 0.89 GPR84 (0.32)
SCHEMBL9718989 0.81
SCHEMBL7931608 0.74 GPR84 (0.34)
SCHEMBL11153958 0.74 GPR84 (0.33)
SCHEMBL29895377 0.73 FDPS (0.33)
SCHEMBL939828 0.69 HSPD1 (0.33)
SCHEMBL2725069 0.69 GPR84 (0.36)
SCHEMBL28539205 0.67 ZDHHC7 (0.36)
SCHEMBL28909070 0.67 ZDHHC7 (0.36)
SCHEMBL28536653 0.67 ZDHHC7 (0.36)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4400545-A1 CONDUIT TUBE AND THERMOPLASTIC POLYESTER ELASTOMER RESIN COMPOSITION TOYOBO MC Corporation (JP) 2024-07-17 EP disclosed
EP-0921143-B1 Thermoplastic polyester elastomer and composition comprising the same TOYO BOSEKI (JP) 2002-08-28 EP disclosed
US-6242560-B1 WHICH SATISFIES CERTAIN RELATIONSHIPS FOR MELTING PONT, VICAT SOFTENING POINT, AND TENSILE ELONGATION; CONTAINS HARD SEGMENTS; WATER RESISTANT, WEATHER RESISTANCE, AND HEAT RESISTANCE TOYO BOSEKI KABUSHIKI KAISHA (JP) 2001-06-05 US disclosed
EP-0921143-A2 Thermoplastic polyester elastomer and composition comprising the same TOYO BOSEKI KABUSHIKI KAISHA (JP) 1999-06-09 EP disclosed