SCHEMBL9155154

SCHEMBL9155154

NCCCNc1ccc(N)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.52
MAPT P10636 3/20 0.44
ALDH1A1 P00352 1/20 0.44
PRSS1 P07477 8/20 0.44
HRH3 Q9Y5N1 1/20 0.43
F2 P00734 2/20 0.42
PRSS2 P07478 2/20 0.42
PRSS3 P35030 2/20 0.42
TMPRSS6 Q8IU80 2/20 0.42
ST14 Q9Y5Y6 2/20 0.42
IDO1 P14902 1/20 0.41
GAA P10253 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
STK17A Q9UEE5 1/20 0.39

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
SCHEMBL457665 0.93 APP (0.50) APPMAPTALDH1A1PRSS1HRH3
SCHEMBL3989706 0.92 APP (0.46) APPMAPTALDH1A1PRSS1CA12
SCHEMBL28385928 0.91 APP (0.49) APPMAPTALDH1A1PRSS1F2
SCHEMBL11934926 0.91 APP (0.49) APPMAPTALDH1A1PRSS1F2
SCHEMBL11748511 0.91 MAPT (0.52) MAPTALDH1A1PRSS1HRH3F2
Hydrochloric Acid SCHEMBL4807054 0.90 MAPT (0.46) APPMAPTALDH1A1PRSS1IDO1
SCHEMBL34107 0.88 PRSS1 (0.54) APPMAPTALDH1A1PRSS1F2
SCHEMBL2024986 0.88 MAPT (0.56) APPMAPTALDH1A1PRSS1F2
SCHEMBL180817 0.88 APP (0.55) APPMAPTALDH1A1PRSS1F2
SCHEMBL12712067 0.86 PRSS1 (0.55) APPMAPTALDH1A1PRSS1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116284805-A Nonionic water-based epoxy curing agent and preparation method and application thereof 江苏富琪森新材料有限公司 2023-06-23 CN claimed
CN-116284805-A Nonionic water-based epoxy curing agent and preparation method and application thereof 江苏富琪森新材料有限公司 2023-06-23 CN disclosed
CN-107548301-B Composition containing menthol as soothing agent 西姆莱斯股份公司 2021-05-11 CN disclosed
US-20140243239-A1 MULTIPLEXED KINASE INHIBITOR BEADS AND USES THEREOF NIH-DEITR 2014-08-28 US disclosed
US-20140243239-A1 MULTIPLEXED KINASE INHIBITOR BEADS AND USES THEREOF NIH-DEITR 2014-08-28 US disclosed
WO-2013055780-A1 MULTIPLEXED KINASE INHIBITOR BEADS AND USES THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2013-04-18 WO disclosed
WO-2013013861-A2 NOVEL OXIDATION DYE PRECURSORS HENKEL AG & CO. KGAA (DE) 2013-01-31 WO disclosed
EP-0356931-B1 Anthrapyridone compounds having vinylsulfone type fiber reactive group through triazinyl bridging group SUMITOMO CHEMICAL CO (JP) 1995-01-18 EP disclosed
EP-0276686-B1 ANTHRAQUINONE COMPOUND AND DYEING OR PRINTING METHOD USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-09-04 EP disclosed
US-4977261-A FIBER-REACTIVE DYES SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1990-12-11 US disclosed
US-4975094-A Anthrapyridone compounds having vinylsulfone type fiber reactive group through triazinyl bridging group SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-12-04 US disclosed