SCHEMBL10071632

SCHEMBL10071632

Bc1ccc(N(c2ccc(CCCC)cc2)c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 12/20 0.68
LPL P06858 11/20 0.68
ESR2 Q92731 1/20 0.41
F11 P03951 2/20 0.41
F2 P00734 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL19074966 0.93 LIPG (0.77) LIPGLPLESR2F11F2
SCHEMBL4366887 0.93 LIPG (0.77) LIPGLPLESR2F11F2
SCHEMBL13874204 0.93 LIPG (0.77) LIPGLPLESR2F11F2
SCHEMBL23966746 0.89 LIPG (0.71) LIPGLPLESR2F11F2
SCHEMBL12669159 0.89 LIPG (0.71) LIPGLPLESR2F11F2
SCHEMBL4151754 0.89 LIPG (0.71) LIPGLPLESR2F11F2
SCHEMBL21310629 0.89 LPL (0.85) LIPGLPLESR2F11F2
SCHEMBL12890200 0.88 LPL (0.86) LIPGLPLESR2F11F2
SCHEMBL15965430 0.88 LPL (0.86) LIPGLPLESR2F11F2
SCHEMBL13471474 0.86 LIPG (0.90) LIPGLPLESR2F11F2

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
US-20120074360-A1 Organic Electronic Material, Ink Composition Containing Same, and Organic Thin Film, Organic Electronic Element, Organic Electroluminescent Element, Lighting Device, and Display Device Formed Therewith HITACHI CHEMICAL COMPANY (JP) 2012-03-29 US disclosed
US-20120074360-A1 Organic Electronic Material, Ink Composition Containing Same, and Organic Thin Film, Organic Electronic Element, Organic Electroluminescent Element, Lighting Device, and Display Device Formed Therewith HITACHI CHEMICAL COMPANY (JP) 2012-03-29 US disclosed