SCHEMBL5376140

SCHEMBL5376140

Cc1ccc(N(C(C)CO)C(C)CO)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
CA7 P43166 1/20 0.35
CYP2C19 P33261 1/20 0.35
ACHE P22303 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
RAB9A P51151 1/20 0.34
GAA P10253 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
ALOX5 P09917 1/20 0.32
CHRNA7 P36544 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
MAPT P10636 1/20 0.31
MCOLN3 Q8TDD5 1/20 0.31

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
SCHEMBL6649994 0.81 ALOX5 (0.34) ALDH1A1MAOAALOX5MAPT
SCHEMBL6650120 0.81 CHRNB2 (0.41) ALDH1A1TSHRTDP1SLC6A2SLC6A4
SCHEMBL2186255 0.80 TRPA1 (0.42) ALDH1A1TSHRSLC6A2SLC6A4MAPT
SCHEMBL29216795 0.80 ALDH1A1 (0.42) ALDH1A1TSHRMAOAMAOBCA7
SCHEMBL2399628 0.76 ACHE (0.39) ALDH1A1ACHETDP1RAB9ASLC6A2
SCHEMBL80210 0.75 ALDH1A1 (0.46) ALDH1A1TSHRMAOAMAOBCA7
SCHEMBL819703 0.74 ALDH1A1 (0.50) ALDH1A1TSHRMAOAMAOBCA7
SCHEMBL25370376 0.74 HSD17B10 (0.38) ALDH1A1TSHRACHEGAASLC6A2
SCHEMBL6648638 0.74 CHRNA1 (0.35) ALDH1A1CYP2C19RAB9ASLC6A2SLC6A4
P-Xylene SCHEMBL27676531 0.73 TSHR (0.56) ALDH1A1TSHRMAOAMAOBCA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1619174-B1 TWO COMPONENT MORTAR AND ITS USE HILTI AG (LI) 2018-05-23 EP claimed
WO-2017117499-A1 FAST CURING, TRANSPARENT AND TRANSLUCENT, NON-HALOGENATED FLAME RETARDANT SYSTEMS FRX POLYMERS, INC. (US) 2017-07-06 WO claimed
US-20170190876-A1 FAST CURING, TRANSPARENT AND TRANSLUCENT, NON-HALOGENATED FLAME RETARDANT SYSTEMS FRX POLYMERS, INC. 2017-07-06 US claimed
US-7238749-B2 Two-component mortar composition and its use HILTI AKTIENGESELLSCHAFT (LI) 2007-07-03 US claimed
US-20060045630-A1 Two-component mortar composition and its use HILTI AKTIENGESELLSCHAFT (LI) 2006-03-02 US claimed
EP-1619174-A2 Two component mortar and its use HILTI Aktiengesellschaft (LI) 2006-01-25 EP claimed
US-20210214471-A1 RADICALLY POLYMERIZABLE PUTTY-LIKE RESIN COMPOSITION, SEALING AGENT AND CRACK REPAIRING METHOD SHOWA DENKO K.K. (JP) 2021-07-15 US disclosed
EP-1619174-B1 TWO COMPONENT MORTAR AND ITS USE HILTI AG (LI) 2018-05-23 EP disclosed
US-20180002562-A1 LOW-TEMPERATURE-CURABLE CROSS-SECTION REPAIR MATERIAL, AND CROSS-SECTION REPAIRING METHOD USING THE SAME SHOWA DENKO K.K. (JP) 2018-01-04 US disclosed
EP-3260479-A1 LOW-TEMPERATURE-CURABLE CROSS-SECTION REPAIR MATERIAL, AND CROSS-SECTION REPAIR METHOD USING SAME Showa Denko K.K. (JP) 2017-12-27 EP disclosed
WO-2017117499-A1 FAST CURING, TRANSPARENT AND TRANSLUCENT, NON-HALOGENATED FLAME RETARDANT SYSTEMS FRX POLYMERS, INC. (US) 2017-07-06 WO disclosed
US-20170190876-A1 FAST CURING, TRANSPARENT AND TRANSLUCENT, NON-HALOGENATED FLAME RETARDANT SYSTEMS FRX POLYMERS, INC. 2017-07-06 US disclosed
US-7238749-B2 Two-component mortar composition and its use HILTI AKTIENGESELLSCHAFT (LI) 2007-07-03 US disclosed
US-20060045630-A1 Two-component mortar composition and its use HILTI AKTIENGESELLSCHAFT (LI) 2006-03-02 US disclosed
EP-1619174-A2 Two component mortar and its use HILTI Aktiengesellschaft (LI) 2006-01-25 EP disclosed
EP-0534197-B1 Cartridge for chemical fixation engineering BASF AG (DE) 1995-12-06 EP disclosed