SCHEMBL19953083

SCHEMBL19953083

C1CCCC(O[Si](OC2CCCCCC2)(OC2CCCCCC2)OC2CCCCCC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA12 O43570 2/20 0.35
CA9 Q16790 2/20 0.35
NPC1 O15118 1/20 0.32
CYP19A1 P11511 1/20 0.31
EPHX1 P07099 1/20 0.31
ACHE P22303 1/20 0.31
LRRK2 Q5S007 2/20 0.31
LOX P28300 1/20 0.31
LOXL2 Q9Y4K0 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
SCHEMBL19952926 1.00 CA1 (0.36) CA1CA2CA12CA9NPC1
SCHEMBL1322990 1.00 CA1 (0.36) CA1CA2CA12CA9NPC1
SCHEMBL10572930 0.97 CA1 (0.32) CA1CA2CA12CA9
SCHEMBL4554487 0.83 NPC1 (0.32) CA1CA2CA12CA9NPC1
SCHEMBL11601772 0.83 NPC1 (0.32) CA1CA2CA12CA9NPC1
SCHEMBL28409059 0.79
SCHEMBL9797589 0.79
SCHEMBL20473702 0.79 PDGFRB (0.30)
SCHEMBL5031088 0.78 CA1 (0.35) CA1CA2CA12CA9NPC1
SCHEMBL11205257 0.77 EPHX1 (0.34) EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018048297-A1 ORGANOSILOXANE HYBRID COMPOSITION FOR ENCAPSULATION OF LIGHT-EMITTING ELEMENTS PENCHEM TECHNOLOGIES SDN. BHD. (MY) 2018-03-15 WO claimed
WO-2018048297-A1 ORGANOSILOXANE HYBRID COMPOSITION FOR ENCAPSULATION OF LIGHT-EMITTING ELEMENTS PENCHEM TECHNOLOGIES SDN. BHD. (MY) 2018-03-15 WO disclosed