SCHEMBL21799673

SCHEMBL21799673

CC(NCCCCCCN)C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.38
CA12 O43570 4/20 0.37
CA2 P00918 4/20 0.37
CA4 P22748 4/20 0.37
CA6 P23280 4/20 0.37
CA5A P35218 4/20 0.37
CA7 P43166 4/20 0.37
CA9 Q16790 4/20 0.37
CA14 Q9ULX7 4/20 0.37
CA5B Q9Y2D0 4/20 0.37
CA1 P00915 3/20 0.37
CA3 P07451 3/20 0.37
TSHR P16473 3/20 0.37
F13A1 P00488 2/20 0.37
CYP1A2 P05177 2/20 0.37
ALOX15 P16050 2/20 0.37
THPO P40225 2/20 0.37
CYP2C9 P11712 1/20 0.37
PKM P14618 1/20 0.37
MTOR P42345 1/20 0.37

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
SCHEMBL21799741 1.00 PAOX (0.38) PAOXCA12CA2CA4CA6
SCHEMBL21799582 1.00 PAOX (0.38) PAOXCA12CA2CA4CA6
SCHEMBL22126222 1.00 PAOX (0.38) PAOXCA12CA2CA4CA6
SCHEMBL21799721 1.00 PAOX (0.38) PAOXCA12CA2CA4CA6
SCHEMBL21799874 1.00 PAOX (0.38) PAOXCA12CA2CA4CA6
SCHEMBL21799632 1.00 PAOX (0.38) PAOXCA12CA2CA4CA6
SCHEMBL21799645 1.00 PAOX (0.38) PAOXCA12CA2CA4CA6
SCHEMBL21800057 0.98 CA12 (0.39) PAOXCA12CA2CA4CA6
SCHEMBL21800040 0.91 CASP2 (0.36) CA12CA2CA4CA6CA5A
SCHEMBL840007 0.89 GRIA1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106471029-B Polymerizable composition for optical material and use thereof 三井化学株式会社 2022-02-22 CN claimed
EP-3623398-B1 RESIN COMPOSITION COMPRISING A MODIFIED BLOCK COPOLYMER AND METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER ASAHI CHEMICAL IND (JP) 2024-08-28 EP disclosed
CN-114685753-B Tissue regeneration promoting type bi-component medical adhesive as well as preparation method and application thereof 广东粤港澳大湾区黄埔材料研究院 2024-01-02 CN disclosed
CN-115302916-A Composite laminates including thermoplastic polyurethane film layers 路博润先进材料公司 2022-11-08 CN disclosed
CN-110603273-B Modified block copolymer, method for producing modified block copolymer, and resin composition 旭化成株式会社 2022-10-14 CN disclosed
CN-114685753-A Tissue regeneration promoting type bi-component medical adhesive and preparation method and application thereof 广东粤港澳大湾区黄埔材料研究院 2022-07-01 CN disclosed
CN-106471029-B Polymerizable composition for optical material and use thereof 三井化学株式会社 2022-02-22 CN disclosed
CN-113939551-A Solvent-borne thermosetting polyamide urethane and/or urea-based coatings 路博润先进材料公司 2022-01-14 CN disclosed
US-11124593-B2 Modified block copolymer, method for producing modified block copolymer, and resin composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-09-21 US disclosed
CN-107250195-B Water-based polyamides and chain extension thereof with isocyanates to form cationic water-based polyurea dispersions 路博润先进材料公司 2021-09-03 CN disclosed
CN-108623777-B Aqueous polyamide-urea dispersions 路博润先进材料公司 2021-07-02 CN disclosed
CN-107223146-B Water-dispersible polyamide structural units 路博润先进材料公司 2020-08-07 CN disclosed
US-20200199282-A1 Modified Block Copolymer, Method for Producing Modified Block Copolymer, and Resin Composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-06-25 US disclosed
CN-111212728-A Composite laminates including thermoplastic polyurethane film layers 路博润先进材料公司 2020-05-29 CN disclosed
CN-111132829-A Multilayer flexible tubular article in fuel line applications 路博润先进材料公司 2020-05-08 CN disclosed
EP-3623398-A1 MODIFIED BLOCK COPOLYMER, METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER, AND RESIN COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2020-03-18 EP disclosed
CN-110603273-A Modified block copolymer, method for producing modified block copolymer, and resin composition 旭化成株式会社 2019-12-20 CN disclosed