SCHEMBL19953014

SCHEMBL19953014

C1CCC(O[Hf](OC2CCCC2)(OC2CCCC2)(OC2CCCC2)OC2CCCC2)C1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
EPHX1 P07099 2/20 0.32
ACHE P22303 1/20 0.32
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
SERPINE1 P05121 1/20 0.30

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
SCHEMBL2884026 0.67
SCHEMBL510834 0.65 CA1 (0.36) CA1CA2EPHX1ACHECA12
SCHEMBL10800200 0.65 CA1 (0.36) CA1CA2EPHX1ACHECA12
SCHEMBL9259717 0.64
SCHEMBL1758112 0.64
SCHEMBL31626845 0.63 CA1 (0.37) CA1CA2EPHX1ACHECA12
SCHEMBL1357594 0.63 ACHE (0.32) CA1CA2EPHX1ACHECA12
SCHEMBL36848 0.62 CA1 (0.41) CA1CA2EPHX1ACHECA12
SCHEMBL9725970 0.62 CA1 (0.41) CA1CA2EPHX1ACHECA12
Phosphine SCHEMBL22634022 0.62 CA1 (0.35) CA1CA2CA12CA9

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