SCHEMBL269057

SCHEMBL269057

COc1ccc(C=Nc2ccc(C)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100B P04271 1/20 0.72
PTGS2 P35354 4/20 0.62
PTGS1 P23219 2/20 0.62
CA12 O43570 2/20 0.62
CA2 P00918 2/20 0.62
CA9 Q16790 2/20 0.62
RELA Q04206 1/20 0.60
ALDH1A1 P00352 6/20 0.59
ACHE P22303 3/20 0.56
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
KDM4E B2RXH2 2/20 0.48
MAPT P10636 2/20 0.48
GAA P10253 1/20 0.48
CYP1A2 P05177 1/20 0.47
TP53 P04637 1/20 0.47
THRB P10828 1/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL16488576 1.00 S100B (0.72) S100BPTGS2PTGS1CA12CA2
SCHEMBL11380636 1.00 S100B (0.72) S100BPTGS2PTGS1CA12CA2
SCHEMBL13038178 1.00 S100B (0.72) S100BPTGS2PTGS1CA12CA2
SCHEMBL10733285 0.92 S100B (0.82) S100BPTGS2PTGS1CA12CA2
SCHEMBL2010515 0.92 S100B (0.82) S100BPTGS2PTGS1CA12CA2
SCHEMBL12416630 0.92 S100B (0.82) S100BPTGS2PTGS1CA12CA2
SCHEMBL10412841 0.92 S100B (0.82) S100BPTGS2PTGS1CA12CA2
SCHEMBL10733277 0.92 S100B (0.82) S100BPTGS2PTGS1CA12CA2
SCHEMBL12416663 0.87 S100B (0.74) S100BPTGS2PTGS1CA12CA2
SCHEMBL255410 0.86 ALDH1A1 (0.74) S100BPTGS2PTGS1CA12CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115745808-B Method for preparing secondary amine compound by catalyzing reduction of imine compound 延安大学 2024-04-30 CN disclosed
CN-115745808-A Method for preparing secondary amine compound by catalyzing reduction of imine compound 延安大学 2023-03-07 CN disclosed
US-20210349035-A1 PATHOGEN MONITORING PLATYPUS TECHNOLOGIES, LLC 2021-11-11 US disclosed
US-20210318231-A1 Liquid Crystal-Based Detection of Air Contaminants Using Metal Surfaces NATIONAL SCIENCE FOUNDATION 2021-10-14 US disclosed
CN-113214102-A Amine-containing transfection reagents and methods of making and using same 生命技术公司 2021-08-06 CN disclosed
US-10928306-B2 Functional surfaces for liquid crystal-based detection of chlorine gas WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2021-02-23 US disclosed
US-20190212254-A1 Functional Surfaces for Liquid Crystal-Based Detection of Chlorine Gas NATIONAL SCIENCE FOUNDATION 2019-07-11 US disclosed
US-20180052111-A1 SUBSTRATES, DEVICES, AND METHODS FOR QUANTITATIVE LIQUID CRYSTAL ASSAYS PLATYPUS TECHNOLOGIES, LLC 2018-02-22 US disclosed
US-9816147-B2 Liquid crystal based analyte detection PLATYPUS TECHNOLOGIES, LLC (US) 2017-11-14 US disclosed
US-9816147-B2 Liquid crystal based analyte detection PLATYPUS TECHNOLOGIES, LLC (US) 2017-11-14 US disclosed
US-20070042505-A1 Liquid crystal based analyte detection PLATYPUS TECHNOLOGIES, LLC (US) 2007-02-22 US disclosed
US-20070004046-A1 Detection of analytes PLATYPUS TECHNOLOGIES, LLC (US) 2007-01-04 US disclosed
EP-0205083-B1 IMAGE FORMING METHOD AND TRANSFER RECORDING MEDIUM THEREFOR CANON KABUSHIKI KAISHA (JP) 1993-09-01 EP disclosed
EP-0261394-B1 IMAGE RECORDING APPARATUS CANON KABUSHIKI KAISHA (JP) 1993-08-11 EP disclosed
US-5015552-A Multilayer optical image recording process involving crosslinking, treatment with heat or light, transferring CANON KABUSHIKI KAISHA (JP) 1991-05-14 US disclosed
US-5005028-A Image forming method and transfer recording medium therefor CANON KABUSHIKI KAISHA (JP) 1991-04-02 US disclosed
US-4990931-A Image forming method and apparatus therefor CANON KABUSHIKI KAISHA (JP) 1991-02-05 US disclosed
US-4978968-A Image recording apparatus CANON KABUSHIKI KAISHA (JP) 1990-12-18 US disclosed
EP-0205083-A2 Image forming method and transfer recording medium therefor CANON KABUSHIKI KAISHA (JP) 1986-12-17 EP disclosed
US-4260743-A Preparation of β-lactams and intermediates therefor GIST-BROCADES N.V. (NL) 1981-04-07 US disclosed