SCHEMBL2925346

SCHEMBL2925346

CCO[Si](C)(OCC)N(C)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
ADH1A P07327 4/20 0.38
ADH1C P00326 3/20 0.38
NPC1 O15118 2/20 0.33
RAB9A P51151 1/20 0.33
TSHR P16473 3/20 0.33
S1PR1 P21453 2/20 0.32
S1PR3 Q99500 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
XBP1 P17861 1/20 0.32
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
POLB P06746 1/20 0.31
CYP2C19 P33261 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
SCHEMBL5607967 0.82 ALDH1A1 (0.36) ALDH1A1ADH1AADH1CNPC1RAB9A
SCHEMBL5090299 0.73 HRH4 (0.36) ALDH1A1ADH1AADH1CTSHRKDM4E
SCHEMBL233210 0.71 ADH1A (0.36) ALDH1A1ADH1AADH1CNPC1TSHR
SCHEMBL236196 0.71 ADH1A (0.36) ALDH1A1ADH1AADH1C
SCHEMBL28594750 0.71 ADH1A (0.42) ALDH1A1ADH1AADH1CS1PR3KDM4E
SCHEMBL4344034 0.71 HRH4 (0.37) ALDH1A1ADH1AADH1CTSHRKDM4E
SCHEMBL4326193 0.71 ADH1A (0.33) ALDH1A1ADH1AADH1CCYP2C19
SCHEMBL2925347 0.71 ADH1A (0.33) ALDH1A1ADH1AADH1C
SCHEMBL231755 0.68 ADH1A (0.33) ALDH1A1ADH1AADH1C
SCHEMBL231394 0.68 ADH1A (0.33) ALDH1A1ADH1AADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105829485-B Photocurable composition with adhesiveness 思美定株式会社 2018-10-12 CN disclosed
US-8772421-B2 Polymers with improved strength comprising mixed oxyalkyl units HENKEL AG & CO. KGAA (DE) 2014-07-08 US disclosed
EP-1668090-B1 COHESION-REDUCED BINDER PRODUCTION AND USE THEREOF IN DETACHABLE ASSEMBLY ADHESIVES HENKEL AG & CO KGAA (DE) 2010-09-08 EP disclosed
US-20060205859-A1 Polyurethane compositions with NCO and silyl reactivity HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2006-09-14 US disclosed
US-20060194930-A1 Polymers with improved strength comprising mixed oxyalkyl units HENKEL AG & CO. KGAA (DE) 2006-08-31 US disclosed
US-20060178470-A1 Cohesion-reduced binder production and use thereof in detachable assembly adhesives HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2006-08-10 US disclosed
EP-1685175-A1 POLYURETHANE COMPOSITIONS WITH NCO AND SILYL REACTIVITY Henkel Kommanditgesellschaft auf Aktien (DE) 2006-08-02 EP disclosed
EP-1668090-A1 COHESION-REDUCED BINDER PRODUCTION AND USE THEREOF IN DETACHABLE ASSEMBLY ADHESIVES Henkel Kommanditgesellschaft auf Aktien (DE) 2006-06-14 EP disclosed
WO-2005049684-A1 POLYURETHANE COMPOSITIONS WITH NCO AND SILYL REACTIVITY HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-06-02 WO disclosed
WO-2005044888-A1 STEAM-BLOCKING POLYURETHANE AND ADHESIVE MOULDED BODY PRODUCED THEREFROM HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-05-19 WO disclosed
WO-2005042610-A2 STORAGE-STABLE POLYURETHANE COMPRISING SILYL GROUPS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-05-12 WO disclosed
WO-2005033241-A1 COHESION-REDUCED BINDER PRODUCTION AND USE THEREOF IN DETACHABLE ASSEMBLY ADHESIVES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-04-14 WO disclosed