SCHEMBL176516

SCHEMBL176516

NCCCN(CCN)CCN

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LCK P06239 3/20 0.52
NFKB1 P19838 1/20 0.40
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA3 P07451 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
CA5A P35218 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
DNM1 Q05193 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
BLM P54132 1/20 0.38
CHRM2 P08172 1/20 0.36

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
SCHEMBL43276 1.00 LCK (0.52) LCKNFKB1CA12CA1CA2
SCHEMBL7166448 1.00 LCK (0.52) LCKNFKB1CA12CA1CA2
SCHEMBL23549865 0.97 LCK (0.50) LCKNFKB1CA12CA1CA2
SCHEMBL15929964 0.97 LCK (0.50) LCKNFKB1CA12CA1CA2
SCHEMBL19655070 0.97 LCK (0.50) LCKNFKB1CA12CA1CA2
SCHEMBL14790716 0.97 LCK (0.50) LCKNFKB1CA12CA1CA2
SCHEMBL10972803 0.94 LCK (0.48) LCKNFKB1CA12CA1CA2
SCHEMBL62173 0.93 NFKB1 (0.46) LCKNFKB1CA12CA1CA2
SCHEMBL17123446 0.91 LCK (0.52) LCKNFKB1CA12CA1CA2
SCHEMBL15591980 0.91 LCK (0.52) LCKNFKB1CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119824572-A Anti-yellowing antibacterial conductive elastic spandex and preparation method thereof 万华化学集团股份有限公司 2025-04-15 CN claimed
CN-116328827-B Preparation of metal-loaded molecular sieve and application of metal-loaded molecular sieve as nitrous oxide decomposition catalyst 黄冈师范学院 2024-07-26 CN claimed
CN-114989383-B Preparation method of environment-friendly polyurethane foaming agent 常州禄泽新材料科技有限公司 2024-04-05 CN claimed
CN-117304801-A Nanometer organosilicon ceramic coating and preparation method thereof 嘉兴富瑞邦新材料科技有限公司 2023-12-29 CN claimed
CN-116328827-A Preparation of metal-loaded molecular sieve and application of metal-loaded molecular sieve as nitrous oxide decomposition catalyst 黄冈师范学院 2023-06-27 CN claimed
CN-115925669-A Preparation method of fluoro ethylene carbonate 青岛科技大学 2023-04-07 CN claimed
CN-115806823-A Silicon selective etchant composition 易安爱富科技有限公司 2023-03-17 CN claimed
CN-115725298-A Silicon selective etchant composition 易安爱富科技有限公司 2023-03-03 CN claimed
CN-115057836-A Ester compound and preparation method and application thereof 浙江糖能科技有限公司 2022-09-16 CN claimed
CN-114989383-A Preparation method of environment-friendly polyurethane foaming agent 曾涛 2022-09-02 CN claimed
CN-106268631-B Graphene-noble metal nano particles Compound Water, aeroge and preparation method thereof, application 中国科学院上海应用物理研究所 2019-11-12 CN claimed
CN-105008022-B Liquid for absorbing and recovering carbon dioxide in gas, and method for recovering carbon dioxide using same 新日铁住金株式会社 2018-06-05 CN claimed
CN-105008022-A Liquid for absorbing and recovering carbon dioxide in gas, and method for recovering carbon dioxide using same NIPPON STEEL & SUMITOMO METAL CORP 2015-10-28 CN claimed
CN-104250005-A Graphene aerogel as well as preparation method and application thereof SHANGHAI INST APPLIED PHYSICS 2014-12-31 CN claimed
WO-2010065660-A2 BIODEGRADABLE POLYDISULFIDE AMINES FOR GENE DELIVERY UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2010-06-10 WO claimed
EP-1620066-A2 ORAL CARE METHODS AND PRODUCTS DMI Biosciences, Inc. (US) 2006-02-01 EP claimed
WO-2004100884-A2 ORAL CARE METHODS AND PRODUCTS DMI BIOSCIENCES, INC. (US) 2004-11-25 WO claimed
US-6599370-B2 Stabilized alkaline compositions for cleaning microelectronic substrates MALLINCKRODT INC. 2003-07-29 US claimed
EP-1174491-A2 Bleaching and oxidation agents and their use Hahn, Ekkehardt (DE) 2002-01-23 EP claimed
US-4559291-A DIFFUSION TRANSFER ASSEMBLAGES USING REDOX DYE-RELEASERS, LIGUAND COMPETES FOR METAL TO METAL HYDROXIDE FORMATION EASTMAN KODAK COMPANY (US) 1985-12-17 US claimed