SCHEMBL5459081

SCHEMBL5459081

CC1(C)c2ccccc2-c2cccc(-c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4-c4ccc(-c5cccc6c5C(C)(C)c5ccccc5-6)cc43)c21

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 17/20 0.40
▸ RARB P10826 1/20 0.35
▸ RARG P13631 1/20 0.35
▸ RXRA P19793 1/20 0.35
▸ ESR1 P03372 1/20 0.35
▸ ESR2 Q92731 1/20 0.35

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
SCHEMBL30345763 1.00 PDK2 (0.40) PDK2RARBRARGRXRAESR1
SCHEMBL10057972 0.93 PDK2 (0.36) PDK2RARBRARGRXRA
SCHEMBL10057539 0.89 PTPRC (0.36) PDK2RARBRARGRXRA
SCHEMBL31409760 0.86 PDK2 (0.42) PDK2
SCHEMBL17102126 0.86 PDK2 (0.42) PDK2
SCHEMBL10057962 0.84 PTPRC (0.36) PDK2RARBRARGRXRAESR1
SCHEMBL3271140 0.84 PGR (0.37) PDK2RARBRARGRXRA
SCHEMBL24156332 0.83 PDK2 (0.35) PDK2
SCHEMBL25847396 0.82 PDK2 (0.35) PDK2RARBRARGRXRA
SCHEMBL23065514 0.82 PDK2 (0.37) PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070161822-A1 Oligofluorene-based compounds and the use thereof LUMINESCENCE TECHNOLOGY CORP. (TW) 2007-07-12 — — US disclosed
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