SCHEMBL4885656

SCHEMBL4885656

COc1c([SiH3])ccc(CCCN)c1OC

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.39
TAAR1 Q96RJ0 3/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
CYP1A2 P05177 1/20 0.34
ADRA1A P35348 1/20 0.32

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
SCHEMBL7764799 0.79 AOC3 (0.34) AOC3
SCHEMBL10863995 0.79 AOC3 (0.47) AOC3TAAR1HTR2AHTR2CHTR2B
SCHEMBL22721269 0.73 PRKCE (0.34) AOC3CYP1A2
SCHEMBL15610427 0.71 CA12 (0.55) TAAR1HTR2ACYP1A2
SCHEMBL21066772 0.70 POLB (0.41)
SCHEMBL21066672 0.70 TSHR (0.43)
SCHEMBL21066719 0.70 TSHR (0.43)
SCHEMBL21066691 0.70 TSHR (0.45)
SCHEMBL23923950 0.69 MPO (0.32)
SCHEMBL21066666 0.69 TSHR (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7419564-B2 Binding agents having barrier properties HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-09-02 US claimed
US-20060162860-A1 Binding agents having barrier properties HENKEL AG & CO. KGAA (DE) 2006-07-27 US claimed
US-20080293872-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-27 US disclosed
US-20080287574-A1 ADHESIVES, SEALANTS AND COATINGS CONTAINING GLASS PARTICLES AS A FILLER HENKEL AG & CO. KGAA (DE) 2008-11-20 US disclosed
US-7419564-B2 Binding agents having barrier properties HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-09-02 US disclosed
US-20060162860-A1 Binding agents having barrier properties HENKEL AG & CO. KGAA (DE) 2006-07-27 US disclosed