SCHEMBL1138049

SCHEMBL1138049

CCC[Si](OC)(OC)OC.NCC(N)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.47
SCN4A P35499 2/20 0.43
ANPEP P15144 1/20 0.42
TACR1 P25103 1/20 0.41
SIGMAR1 Q99720 3/20 0.41
SLC6A2 P23975 2/20 0.41
TAAR1 Q96RJ0 2/20 0.41
MAOA P21397 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
CYP2A6 P11509 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
MMP2 P08253 2/20 0.40
CSNK1E P49674 1/20 0.39
CYP2D6 P10635 1/20 0.39
ALDH1A1 P00352 1/20 0.38

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
Hydrochloric Acid SCHEMBL4440714 0.98 EPHX1 (0.46) EPHX1SCN4AANPEPTACR1SIGMAR1
SCHEMBL614446 0.81 EPHX1 (0.53) EPHX1SCN4AANPEPTACR1SIGMAR1
Benzylamine SCHEMBL8464424 0.80 LOXL2 (0.52) SIGMAR1SLC6A2TAAR1MAOASLC6A4
Benzylamine SCHEMBL18151475 0.79 LOXL2 (0.50) SIGMAR1SLC6A2TAAR1MAOASLC6A4
SCHEMBL243771 0.78 EPHX1 (0.76) EPHX1SCN4AANPEPSIGMAR1SLC6A2
SCHEMBL3441656 0.78 EPHX1 (0.76) EPHX1SCN4AANPEPSIGMAR1SLC6A2
SCHEMBL137074 0.78 EPHX1 (0.76) EPHX1SCN4AANPEPSIGMAR1SLC6A2
Hydrochloric Acid SCHEMBL18547947 0.76 EPHX1 (0.73) EPHX1SCN4AANPEPSIGMAR1SLC6A2
SCHEMBL9583547 0.76 EPHX1 (0.73) EPHX1SCN4AANPEPSIGMAR1SLC6A2
Hydrochloric Acid SCHEMBL5567986 0.76 EPHX1 (0.73) EPHX1SCN4AANPEPSIGMAR1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2853546-B1 Modified starch compositions, starch composite foam materials and method for preparing the starch composite foam material IND TECH RES INST (TW) 2016-05-25 EP claimed
US-9175187-B2 Self-etching cementitious substrate coating composition VALSPAR SOURCING, INC. (US) 2015-11-03 US claimed
EP-2109590-B1 SILANE SUBSTITUTED POLYETHYLENE OXIDE REAGENTS AND METHOD OF USING FOR PREVENTING OR REDUCING ALUMINOSILICATE SCALE IN INDUSTRIAL PROCESSES CYTEC TECH CORP (US) 2013-05-15 EP claimed
US-7988863-B2 Silane substituted polyalkylene oxide reagents and methods of using for preventing or reducin aluminosilicate scale in industrial processes CYTEC TECHNOLOGY CORP. (US) 2011-08-02 US claimed
US-20110151265-A1 SELF-ETCHING CEMENTITIOUS SUBSTRATE COATING COMPOSITION VALSPAR SOURCING INC. 2011-06-23 US claimed
EP-2326691-A2 SELF-ETCHING CEMENTITIOUS SUBSTRATE COATING COMPOSITION Valspar Sourcing, Inc. (US) 2011-06-01 EP claimed
US-20100116750-A1 SILANE SUBSTITUTED POLYALKYLENE OXIDE REAGENTS AND METHODS OF USING FOR PREVENTING OR REDUCIN ALUMINOSILICATE SCALE IN INDUSTRIAL PROCESSES CYTEC TECHNOLOGY CORP. (US) 2010-05-13 US claimed
WO-2010019825-A2 SELF-ETCHING CEMENTITIOUS SUBSTRATE COATING COMPOSITION VALSPAR SOURCING, INC. (US) 2010-02-18 WO claimed
EP-2109590-A1 SILANE SUBSTITUTED POLYETHYLENE OXIDE REAGENTS AND METHOD OF USING FOR PREVENTING OR REDUCING ALUMINOSILICATE SCALE IN INDUSTRIAL PROCESSES CYTEC TECHNOLOGY CORP. (US) 2009-10-21 EP claimed
WO-2008097671-A1 SILANE SUBSTITUTED POLYETHYLENE OXIDE REAGENTS AND METHOD OF USING FOR PREVENTING OR REDUCING ALUMINOSILICATE SCALE IN INDUSTRIAL PROCESSES CYTEC TECHNOLOGY CORP. (US) 2008-08-14 WO claimed
EP-1945750-A2 MICROARRAY HAVING A BASE CLEAVABLE SUCINATE LINKER Combimatrix Corporation (US) 2008-07-23 EP claimed
US-20080125327-A1 Bonding amino moieties to solid surface with reactive hydroxyl groups, bonding succinate moieties to the amine groups through amide bonds to form cleavable linkers attached to the solid surface, bonding a succinate group, a sugar group and a base group, synthesizing oligonucleotides CUSTOMARRAY, INC. 2008-05-29 US claimed
US-20080111103-A1 SILANE SUBSTITUTED POLYETHYLENE OXIDE REAGENTS AND METHOD OF USING FOR PREVENTING OR REDUCING ALUMINOSILICATE SCALE IN INDUSTRIAL PROCESSES CYTEC TECHNOLOGY CORP. 2008-05-15 US claimed
WO-2007035500-A2 MICROARRAY HAVING A BASE CLEAVABLE SUCCINATE LINKER COMBIMATRIX CORPORATION (US) 2007-03-29 WO claimed
US-20070065877-A1 Microarray having a base cleavable succinate linker COMBIMATRIX CORPORATION 2007-03-22 US claimed
US-20200362191-A1 HIGH PERFORMANCE AQUEOUS COATING COMPOSITIONS SWIMC LLC 2020-11-19 US disclosed
EP-3728495-A1 HIGH PERFORMANCE AQUEOUS COATING COMPOSITIONS SWIMC LLC (US) 2020-10-28 EP disclosed
US-20070114030-A1 Methods of modifying particulate surfaces to affect acidic sites thereon HALLIBURTON ENERGY SERVICES, INC. 2007-05-24 US disclosed
WO-2007035500-A2 MICROARRAY HAVING A BASE CLEAVABLE SUCCINATE LINKER COMBIMATRIX CORPORATION (US) 2007-03-29 WO disclosed
US-20070065877-A1 Microarray having a base cleavable succinate linker COMBIMATRIX CORPORATION 2007-03-22 US disclosed